[ CAS No. 55368-42-8 ] {[proInfo.proName]}

Name: 55368-42-8|4-Bromobenzimidamide hydrochloride|98%
Brand: Ambeed
SKU: A124216
Price: 5.0 USD
Availability: InStock
Rating: 92 (29 reviews)

,{[proInfo.pro_purity]}

Cat. No.: {[proInfo.prAm]}

2D 3D

Structure of 55368-42-8 * Storage: {[proInfo.prStorage]}

Cart0 Add to My Favorites Add to My Favorites Bulk Inquiry Inquiry Add To Cart

Search after Editing

* Storage: {[proInfo.prStorage]}

For Research Only 110K+ Compounds Competitive Price 1-2 Day Shipping

Quality Control of [ 55368-42-8 ]

COA NMR CNMR HPLC LC-MS

Related Doc. of [ 55368-42-8 ]

SDS Specification

Alternatived Products of [ 55368-42-8 ]

Product Details of [ 55368-42-8 ]

CAS No. :	55368-42-8	MDL No. :	MFCD00464967
Formula :	C₇H₈BrClN₂	Boiling Point :	-
Linear Structure Formula :	-	InChI Key :	IMTHEBSPHHMJOJ-UHFFFAOYSA-N
M.W :	235.51	Pubchem ID :	12207714
Synonyms :

Calculated chemistry of [ 55368-42-8 ]

Physicochemical Properties

Num. heavy atoms :	11
Num. arom. heavy atoms :	6
Fraction Csp3 :	0.0
Num. rotatable bonds :	1
Num. H-bond acceptors :	1.0
Num. H-bond donors :	2.0
Molar Refractivity :	52.37
TPSA :	49.87 Å²

Pharmacokinetics

GI absorption :	High
BBB permeant :	Yes
P-gp substrate :	No
CYP1A2 inhibitor :	No
CYP2C19 inhibitor :	No
CYP2C9 inhibitor :	No
CYP2D6 inhibitor :	No
CYP3A4 inhibitor :	No
Log Kp (skin permeation) :	-6.54 cm/s

Lipophilicity

Log Po/w (iLOGP) :	0.0
Log Po/w (XLOGP3) :	1.68
Log Po/w (WLOGP) :	2.54
Log Po/w (MLOGP) :	2.67
Log Po/w (SILICOS-IT) :	1.78
Consensus Log Po/w :	1.73

Druglikeness

Lipinski :	0.0
Ghose :	None
Veber :	0.0
Egan :	0.0
Muegge :	0.0
Bioavailability Score :	0.55

Water Solubility

Log S (ESOL) :	-2.7
Solubility :	0.474 mg/ml ; 0.00201 mol/l
Class :	Soluble
Log S (Ali) :	-2.34
Solubility :	1.07 mg/ml ; 0.00455 mol/l
Class :	Soluble
Log S (SILICOS-IT) :	-2.99
Solubility :	0.242 mg/ml ; 0.00103 mol/l
Class :	Soluble

Medicinal Chemistry

PAINS :	0.0 alert
Brenk :	2.0 alert
Leadlikeness :	1.0
Synthetic accessibility :	1.39

Safety of [ 55368-42-8 ]

Signal Word:	Warning	Class:	N/A
Precautionary Statements:	P261-P305+P351+P338	UN#:	N/A
Hazard Statements:	H302-H315-H319-H335	Packing Group:	N/A
GHS Pictogram:

Application In Synthesis of [ 55368-42-8 ]

* All experimental methods are cited from the reference, please refer to the original source for details. We do not guarantee the accuracy of the content in the reference.

Upstream synthesis route of [ 55368-42-8 ]
Downstream synthetic route of [ 55368-42-8 ]

[ 55368-42-8 ] Synthesis Path-Upstream 1~5

1
[ 55368-42-8 ]
[ 22265-36-7 ]

Yield	Reaction Conditions	Operation in experiment
472 mg	With sodium hydroxide In water	4-Bromobenzamidine hydrochloride (6a, 707 mg) was treated with 5 M aqueous sodium hydroxide (8 mL), and extracted with chloroform. The organic layer was dried, filtered and evaporated to give colorless solid (472 mg). To the solution of the obtained solid in ethanol (5 mL) was added ethyl propiolate (0.27 mL) and the mixture was warmed up to 60 °C, then potassium hydroxide (175 mg) in ethanol (4 mL) was added dropwise over 15 min. The mixture was warmed up to 80 °C and stirred for 6 h, then cooled down to room temperature. To the mixture was added 1 M hydrochloric acid (10 mL), and the precipitate was collected by filtration, washed with water, dried in vacuo at 50 °C overnight to give 7g (267 mg, 35percent) as a pale brown solid: ¹H NMR (DMSO-d₆) δ 6.25-6.50 (1H, m), 7.74 (2H, d, J = 8.3 Hz), 7.95-8.25 (3H, m), 12.50-13.20 (1H, br); FAB-MS m/z 251, 253 [(M+H)⁺].
9.58 g	With sodium hydroxide In water at 20℃; for 3 h;	Compound 3 (13.25 g) was suspended in water (40 mL), and a 5N aqueous sodium hydroxide solution (40 mL)was added, and the mixture was stirred at room temperature for 3 hours. The deposit was collected by filtration andwashed with water. The obtained white solid was dissolved in acetone, activated charcoal was added, and the mixturewas stirred for 10 minutes, and subsequently, filtered through Celite. The filtrate was concentrated under reducedpressure, and the obtained powder was washed with diethyl ether, collected by filtration and dried to obtain Compound4 (9.58 g) as a white powder.

Reference： [1] Bioorganic and Medicinal Chemistry, 2012, vol. 20, # 7, p. 2369 - 2375
[2] Patent: EP2862856, 2015, A1, . Location in patent: Paragraph 0651; 0652
[3] Tetrahedron Letters, 2018, vol. 59, # 4, p. 361 - 364

2
[ 623-00-7 ]
[ 55368-42-8 ]

Yield	Reaction Conditions	Operation in experiment
97%	Stage #1: With hydrogenchloride In ethanol; chloroform at -65 - 20℃; Stage #2: With ammonium carbonate In ethanol at 20℃; for 20 h;	Hydrogen chloride gas was passed through a solution of 4-bromobenzonitrile (18.2 g) in chloroform (300 mL) and ethanol (100 mL) at -65 °C for 35 min. Then the solution was warmed up to room temperature, and stirred at room temperature overnight. The solution was evaporated in vacuo, and the resulting residue was dissolved in ethanol (400 mL). To the solution was added ammonium carbonate (48.0 g), and the reaction mixture was stirred at room temperature for 20 h. To the mixture was added water (300 mL), and ethanol was removed by concentration in vacuo. The resulting precipitate was collected by filtration, and washed with water, dried in vacuo to give 6a (22.9 g, 97percent) as a white solid: ¹H NMR (DMSO-d₆) δ 2.55-4.60 (2H, br), 6.30-8.90 (6H, m); FAB-MS m/z 199, 201 [(M+H)⁺].
85%	Stage #1: With sodium hexamethyldisilazane In tetrahydrofuran at 20℃; for 1 h; Stage #2: With hydrogenchloride In water	4.2.18 4-Bromobenzimidamide hydrochloride (24) Beige solid; yield: 85percent. ¹H NMR (400 MHz, d₆-DMSO): δ 9.58 (br s, 2H), 9.42 (br s, 2H), 7.85 (d, J = 8.0 Hz, 2H), 7.81 (d, J = 8.0 Hz, 2H). ¹³C NMR (101 MHz, d₆-DMSO): δ 165.4 (C), 132.5 (2CH), 130.7 (2CH), 128.1 (C), 127.7 (C). IR (neat, ν/cm^-1): 3322 (br s), 3135 9br s), 1669 (s), 1593 (s), 1480 (m), 1428 (m), 1071 (m), 1009 (m), 841 (m), 776 (m), 695 (s), 623 (s). HRMS (ES-TOF⁺) calculated for C₇H₈N₂Br 198.9871, found 198.9873.

Reference： [1] Bioorganic and Medicinal Chemistry, 2012, vol. 20, # 7, p. 2369 - 2375
[2] Bioorganic and Medicinal Chemistry, 2017, vol. 25, # 23, p. 6218 - 6223
[3] Magnetic Resonance in Chemistry, 1987, vol. 25, p. 923 - 927
[4] Physical Chemistry Chemical Physics, 2004, vol. 6, # 4, p. 756 - 765
[5] Tetrahedron Letters, 2018, vol. 59, # 4, p. 361 - 364

3
[ 19227-14-6 ]
[ 55368-42-8 ]

Reference： [1] Synthetic Communications, 2011, vol. 41, # 15, p. 2195 - 2199

4
[ 64-17-5 ]
[ 623-00-7 ]
[ 55368-42-8 ]

Reference： [1] Molecular Crystals and Liquid Crystals Science and Technology Section A: Molecular Crystals and Liquid Crystals, 1995, vol. 260, # pt 1, p. 139 - 156

5
[ 64-17-5 ]
[ 55368-42-8 ]

Reference： [1] Patent: US5326497, 1994, A,

[ 55368-42-8 ] Synthesis Path-Downstream 1~23

1
[ 623-00-7 ]
[ 55368-42-8 ]

Yield	Reaction Conditions	Operation in experiment
97%	Stage #1: 4-bromobenzenecarbonitrile With hydrogenchloride In ethanol; chloroform at -65 - 20℃; Stage #2: With ammonium carbonate In ethanol at 20℃; for 20h;	5.1.1. 4-Bromobenzamidine hydrochloride (6a) Hydrogen chloride gas was passed through a solution of 4-bromobenzonitrile (18.2 g) in chloroform (300 mL) and ethanol (100 mL) at -65 °C for 35 min. Then the solution was warmed up to room temperature, and stirred at room temperature overnight. The solution was evaporated in vacuo, and the resulting residue was dissolved in ethanol (400 mL). To the solution was added ammonium carbonate (48.0 g), and the reaction mixture was stirred at room temperature for 20 h. To the mixture was added water (300 mL), and ethanol was removed by concentration in vacuo. The resulting precipitate was collected by filtration, and washed with water, dried in vacuo to give 6a (22.9 g, 97%) as a white solid: 1H NMR (DMSO-d6) δ 2.55-4.60 (2H, br), 6.30-8.90 (6H, m); FAB-MS m/z 199, 201 [(M+H)+].
85%	Stage #1: 4-bromobenzenecarbonitrile With sodium hexamethyldisilazane In tetrahydrofuran at 20℃; for 1h; Stage #2: With hydrogenchloride In water	18 3-Bromobenzimidamide hydrochloride (23) 4.2.18 4-Bromobenzimidamide hydrochloride (24) Beige solid; yield: 85%. 1H NMR (400 MHz, d6-DMSO): δ 9.58 (br s, 2H), 9.42 (br s, 2H), 7.85 (d, J = 8.0 Hz, 2H), 7.81 (d, J = 8.0 Hz, 2H). 13C NMR (101 MHz, d6-DMSO): δ 165.4 (C), 132.5 (2CH), 130.7 (2CH), 128.1 (C), 127.7 (C). IR (neat, ν/cm-1): 3322 (br s), 3135 9br s), 1669 (s), 1593 (s), 1480 (m), 1428 (m), 1071 (m), 1009 (m), 841 (m), 776 (m), 695 (s), 623 (s). HRMS (ES-TOF+) calculated for C7H8N2Br 198.9871, found 198.9873.
60%

	With ammonium chloride; sodium In methanol at 35℃; for 72h;
	Stage #1: 4-bromobenzenecarbonitrile With sodium methylate In methanol for 48h; Inert atmosphere; Stage #2: With ammonium chloride In methanol at 20℃; for 24h; Inert atmosphere;	General procedure for synthesis of aryl amidines General procedure: A 100 mL flask was charged with 30 mL of anhydrous MeOH, 10 mmol of the arylnitrile, and 1.0 mmol of sodium methoxide. The complex was protected from moisture and stirred for 48 h. Then, 10 mmol of NH4Cl was added and stirring was continued for 24 h. Unreacted NH4Cl was filtered, and methanol was stripped from the filtrate to afford the product aryl amidine hydrochlorides, which was dissolved in 2.5 mL 8M sodium hydroxide aqueous solution and stirred for 1 h. Then chloroform (20 ml x 3) and H2O (20 ml x 3) were added successively to extract the product, and the combined organic layer was dried with anhydrous MgSO4 and then evaporated under vacuum to remove the organic solvent to give the desired arylamidine.

Reference： [1]Location in patent: experimental part Negoro, Kenji; Yonetoku, Yasuhiro; Maruyama, Tatsuya; Yoshida, Shigeru; Takeuchi, Makoto; Ohta, Mitsuaki [Bioorganic and Medicinal Chemistry, 2012, vol. 20, # 7, p. 2369 - 2375]
[2]Baumann, Marcus; Baxendale, Ian R. [Bioorganic and Medicinal Chemistry, 2017, vol. 25, # 23, p. 6218 - 6223]
[3]Terpinski, Jacek; Denney, Dorothy Z.; Beveridge, Richard; Cox, Phillip D.; Moss, Robert A. [Magnetic Resonance in Chemistry, 1987, vol. 25, p. 923 - 927]
[4]Thompson, Robert A.; Francisco, Joseph S.; Grutzner, John B. [Physical Chemistry Chemical Physics, 2004, vol. 6, # 4, p. 756 - 765]
[5]Lu, Xiaodong; Xin, Xiaoyi; Wan, Boshun [Tetrahedron Letters, 2018, vol. 59, # 4, p. 361 - 364]

2
[ 55368-42-8 ]
[ 146137-79-3 ]
2-(4-bromo-phenyl)-quinazoline-6-carbonitrile [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
68.2%	With potassium carbonate; In acetonitrile; at 80℃; for 10h;Molecular sieve;	Add 50g of intermediate 1-1 to a 1L three-necked flask.22.6 g of intermediate 5-1,29.3g potassium carbonate,30g 4A molecular sieve,500ml acetonitrile,The temperature was raised to 80 ° C and the reaction was stirred for 10 h.After the TLC was monitored, the starting material was completely reacted and then cooled to room temperature. The reaction mixture was concentrated by filtration. The obtained crude product was dissolved in 300 ml of DCM and washed with water to neutral. The organic phase was dried over anhydrous sodium sulfate and concentrated, and the obtained crude product was obtained as a white solid. g, yield 68.2percent.

Reference： [1]Patent: CN109293583,2019,A .Location in patent: Paragraph 0056-0057
[2]Synlett,1999,p. 1993 - 1995

3
[ 19227-14-6 ]
[ 55368-42-8 ]

Yield	Reaction Conditions	Operation in experiment
80%	Stage #1: p-bromobenzamidoxime With acetic anhydride; acetic acid at 20℃; for 0.5h; Stage #2: With triethylsilane; palladium dichloride at 70 - 75℃; for 2.5h; Stage #3: With hydrogenchloride In ethanol

Reference： [1]Location in patent: experimental part Mahajan, Umesh S.; Godinde, Rupesh R.; Mandhare [Synthetic Communications, 2011, vol. 41, # 15, p. 2195 - 2199]

4
[ 55368-42-8 ]
[ 330981-72-1 ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 3 steps 1.1: sodium methylate / methanol / 0.17 h / 20 °C 1.2: 20 - 65 °C 2.1: trichlorophosphate / 2 h / 80 °C 3.1: acetonitrile / 20.5 h / 70 - 85 °C

Reference： [1]Negoro, Kenji; Yonetoku, Yasuhiro; Maruyama, Tatsuya; Yoshida, Shigeru; Takeuchi, Makoto; Ohta, Mitsuaki [Bioorganic and Medicinal Chemistry, 2012, vol. 20, # 7, p. 2369 - 2375]

5
[ 55368-42-8 ]
[ 30414-54-1 ]
[ 1153408-43-5 ]

Yield	Reaction Conditions	Operation in experiment
80%		General procedure: To a solution of 4-bromobenzamidine hydrochloride (6a, 12.7 g) in methanol (200 mL) was added sodium methoxide (2.9 g), and the mixture was stirred at room temperature for 10 min. To the mixture methyl acetoacetate (6.0 mL) and sodium methoxide (8.72 g) were added, and the reaction mixture was stirred at room temperature for 4 days. The reaction mixture was warmed up to 50 C, and was stirred at the same temperature for 1 day. The reaction mixture was warmed up to 65 C, and was stirred at the same temperature for 5 h. The mixture was cooled down to 5 C, then 1 M hydrochloric acid (300 mL) was added to the mixture. The resulting precipitate was collected by filtration, washed with water, and dried in vacuo at 50 C overnight to give 7a (8.98 g, 63%) as a white solid.

Reference： [1]Bioorganic and Medicinal Chemistry,2012,vol. 20,p. 2369 - 2375

6
[ 55368-42-8 ]
[ 536-60-7 ]
2,4-bis(4-bromophenyl)-6-(4-isopropylphenyl)-1,3,5-triazine [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
66%	With oxygen; copper(II) acetate monohydrate; sodium carbonate In toluene at 110℃; for 24h;
66%	With copper(II) acetate monohydrate; sodium carbonate In toluene at 120℃; for 24h;	9 Synthesis of 2,4-dibromophenyl-6-(4-isopropylphenyl)-1,3,5-triazine, including the following steps: 20 mmol of 4-bromobenzamidine hydrochloride and 14 mmol of 4-isopropylbenzyl alcohol were taken in a 100 mL round bottom flask. 2 mmol Cu(OAc)2·H2O was added to it, 20 mmol Na2CO3 and 30 mL toluene were added and stirred at 120 ° C for 24 hours. The product was extracted with ethyl acetate and dried to obtain a crude product. The crude product was purified by silica gel column chromatography (yield: petroleum ether: ethyl acetate: 100:1) to give a white solid, 2,4-dibromophenyl-6-(4-isopropylphenyl)-1,3,5-triazine, Yield 66%. The melting point is 181 ° C.

Reference： [1]You, Qing; Wang, Fei; Wu, Chaoting; Shi, Tianchao; Min, Dewen; Chen, Huajun; Zhang, Wu [Organic and Biomolecular Chemistry, 2015, vol. 13, # 24, p. 6723 - 6727]
[2]Current Patent Assignee: ANHUI NORMAL UNIVERSITY - CN104262273, 2017, B Location in patent: Paragraph 0080-0082

7
[ 533-58-4 ]
[ 55368-42-8 ]
[ 3164-13-4 ]

Reference： [1]Organic and Biomolecular Chemistry,2016,vol. 14,p. 7920 - 7926

8
[ 95-56-7 ]
[ 55368-42-8 ]
[ 3164-13-4 ]

Reference： [1]Organic and Biomolecular Chemistry,2016,vol. 14,p. 7920 - 7926

9
[ 55368-42-8 ]
[ 94-41-7 ]
[ 457613-56-8 ]

Yield	Reaction Conditions	Operation in experiment
60.3%	With cholin hydroxide at 60℃;	6 Example 6 Synthesis of Compound 82 150 ml three-necked flask, 0.01 mol of compound A3, 0.01 mol of compound B4,30ml Cholinehydroxide. Heat to 60 ° C, after the reaction is completed, cool to room temperature. Add 60 ml of distilled water, suction filtration, and filter cake with ethanol for 2 times, through a silica gel column.Intermediate C14 was obtained with a purity of 98.70% and a yield of 60.3%.
44%	With potassium hydroxide In ethanol; water for 6h; Reflux; Inert atmosphere;

Reference： [1]Current Patent Assignee: VALIANT CO., LTD. - CN108239070, 2018, A Location in patent: Paragraph 0101; 0104; 0105
[2]Ganesan, Paramaguru; Ranganathan, Revathi; Chi, Yun; Liu, Xiao-Ke; Lee, Chun-Sing; Liu, Shih-Hung; Lee, Gene-Hsiang; Lin, Tzu-Chieh; Chen, Yi-Ting; Chou, Pi-Tai [Chemistry - A European Journal, 2017, vol. 23, # 12, p. 2858 - 2866]

10
[ 10342-83-3 ]
[ 55368-42-8 ]
[ 100097-62-9 ]

Yield	Reaction Conditions	Operation in experiment
78%	With ferrous(II) sulfate heptahydrate; 1,10-Phenanthroline; 2,2,6,6-Tetramethyl-1-piperidinyloxy free radical; In N,N-dimethyl-formamide; at 120℃; for 12h;Sealed tube;	0.3 mmol of 4-bromobenzamidine hydrochloride (0.0707 g), 0.75 mmol of 4-bromophenylacetone (0.1598 g)0.03 mmol of ferrous sulfate heptahydrate (0.0083 g), 0.03 mmol of 1,1,10-phenanthroline (0.0054 g), tetramethylpiperidine nitrogen(TEMPO) (0.0563 g) was added to a 10 mL test tube reaction tube, and 2 mL of N, N-dimethylformamide (DMF) was added as a solvent.The reaction was carried out in the order of water, ethyl acetate, anhydrous sodium sulfateDrying and column chromatography (column chromatography separation conditions: fixed phase of 300 ~ 400 mesh silica gel powder, the mobile phase ethyl acetate (A)And petroleum ether (B), the mobile phase change program (A: B) was 1: 50 ? 1: 20, 0.0914 g of the reaction product (white solid) was obtained. According to the characterization data, the obtained reaction produces pure 2,4-bis (4-bromophenyl) pyrimidine (purity> 95%),As follows:The product yield was calculated and the result was 78%.

Reference： [1]Patent: CN106496127,2017,A .Location in patent: Paragraph 0204; 0205; 0206; 0208; 0209; 0210
[2]Journal of Organic Chemistry,2017,vol. 82,p. 1145 - 1154

11
[ 16185-96-9 ]
[ 55368-42-8 ]
2-(4-bromophenyl)-4-(2-(trifluoromethyl)phenyl)pyrimidine [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
45%	With ferrous(II) sulfate heptahydrate; 1,10-Phenanthroline; 2,2,6,6-Tetramethyl-1-piperidinyloxy free radical In N,N-dimethyl-formamide at 120℃; for 12h; Sealed tube;	23 Example 23 Synthesis of 2- (4-bromophenyl) -4- (2-trifluoromethylphenyl) pyrimidine Weigh 0.3 mmol of 4-bromobenzamidine hydrochloride (0.0707 g), 0.75 mmol of 2-trifluoromethylphenylacetone(0.1516 g), 0.03 mmol ferrous sulfate heptahydrate (0.0083 g), 0.03 mmol 1,10-phenanthroline (0.0054 g), tetrakisMethylpiperidine nitrogen oxide (TEMPO) (0.0563 g) was added to 10 mL of the test tube reaction tube and 2 mL of N, N-dimethylformamide(DMF) as solvent, sealing and sealing, stirring at 120 for 12 hours; after the end of the reaction, the reaction solution after water,Ester, dried over anhydrous sodium sulfate and column chromatography (column chromatography separation conditions: the stationary phase was 300-400 mesh silica gel, the mobile phase(A: B) was 1: 50 → 1: 20 for ethyl acetate (A) and petroleum ether (B), 0.0507 g of the reaction product(White solid). According to the characterization data, the reaction was carried out to produce 2- (4-bromophenyl) -4- (2-trifluoromethylphenyl) pyrimidine(Purity> 95%), the structure is as follows:The product yield was calculated with a result of 45%.
45%	With ferrous(II) sulfate heptahydrate; 1,10-Phenanthroline; 2,2,6,6-Tetramethyl-1-piperidinyloxy free radical; N,N-dimethyl-formamide at 120℃; for 17h; regioselective reaction;

Reference： [1]Current Patent Assignee: SOOCHOW UNIVERSITY (SUZHOU) - CN106496127, 2017, A Location in patent: Paragraph 0211; 0212; 0213; 0214; 0215; 0216; 0217
[2]Chu, Xue-Qiang; Cao, Wen-Bin; Xu, Xiao-Ping; Ji, Shun-Jun [Journal of Organic Chemistry, 2017, vol. 82, # 2, p. 1145 - 1154]

12
[ 13679-75-9 ]
[ 55368-42-8 ]
2-(4-bromophenyl)-4-(thiophen-2-yl)pyrimidine [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
79%	With ferrous(II) sulfate heptahydrate; 1,10-Phenanthroline; 2,2,6,6-Tetramethyl-1-piperidinyloxy free radical; In N,N-dimethyl-formamide; at 120℃; for 12h;Sealed tube;	Weigh 0.3 mmol of 4-bromobenzamidine hydrochloride (0.0707 g)0.75 mmol of 2-acetylthiophene (0.1052 g),0.03 mmol of ferrous sulfate heptahydrate (0.0083 g), 0.03 mmol of 1,1,10-phenanthroline (0.0054 g), tetramethylpiperidineNitrogen oxide (TEMPO) (0.0563 g) was added to a 10 mL tube of test tubes and 2 mL of N, N-dimethylformamide (DMF) was addedAnd the mixture was sealed and sealed at 120 C for 12 hours. After the reaction, the reaction solution was successively passed through water, ethyl acetate, anhydrous sulfurSodium sulfate and column chromatography (column chromatography separation conditions: the stationary phase of 300 ~ 400 mesh silica gel, the mobile phase ethyl acetate(A) and petroleum ether (B), the mobile phase change program (A: B) is 1: 50 ? 1: 20, 0.0751 g of the reaction product (white solidbody). According to the characterization data, the obtained reaction produces pure 2- (4-bromophenyl) -4- (2-thienyl) pyrimidine (purity>95%), the structure is as follows:The product yield was calculated and 79%.

Reference： [1]Patent: CN106496127,2017,A .Location in patent: Paragraph 0239; 0240; 0241; 0242; 0243; 0244; 0245
[2]Journal of Organic Chemistry,2017,vol. 82,p. 1145 - 1154

13
[ 55368-42-8 ]
[ 127956-11-0 ]
[ 1450790-53-0 ]

Yield	Reaction Conditions	Operation in experiment
63.6%	With potassium carbonate; In methanol; at 85℃; for 4h;Inert atmosphere;	The <strong>[127956-11-0]methyl 4-oxotetrahydro-2H-pyran-3-carboxylate</strong>(564 mg, 3 . 57 mmol), 4-bromobenzimidamide hydrochloride(1.01 g, 4 . 28 mmol) and potassium carbonate (985.3 mg, 7 . 14 mmol) is added to methanol (40 ml) in, under the protection of nitrogen upto 85 C reaction 4 hours, TLC detection reaction is complete, lowering the temperature to 0 C, white solid precipitated, filtered, the filter cake is dried under vacuum to get the title compound (700 mg, yield 63.6%).

Reference： [1]Patent: CN107286169,2017,A .Location in patent: Paragraph 0136-0138

14
[ 55368-42-8 ]
[ 1493-27-2 ]
[ 2622-74-4 ]

Yield	Reaction Conditions	Operation in experiment
88%	With potassium carbonate; copper(I) bromide In dimethyl sulfoxide at 120℃; for 8h;	Synthesis of benzimidazole derivatives 3a-h General procedure: A mixture of 1-fluoro-2-nitrobenzene (1) (0.141 g,1.0 mmol), the appropriate benzamidine hydrochloride 2a-h (1.0 mmol), CuBr (0.029 g, 0.2 mmol), and K2CO3 (0.276 g,2.0 mmol) in dry DMSO (3.0 ml) was heated in a round bottom flask for 8 h at 120°C. After the reaction was complete (TLC), the mixture was cooled, quenched with water (20 ml), and extracted with EtOAc (3 × 20 ml). The extract was washed with 20% aqueous NaCl solution, dried over Na2SO4, and concentrated under reduced pressure.The residue was purified by column chromatography using petroleum ether - ethyl acetate, 4:1, as eluent to afford the pure products.

Reference： [1]Sayahi, Mohammad Hosein; Khoshneviszadeh, Mehdi; Soheilizad, Mehdi; Saghanezhad, Seyyed Jafar; Mahdavi, Mohammad [Chemistry of Heterocyclic Compounds, 2018, vol. 54, # 3, p. 351 - 354][Khim. Geterotsikl. Soedin., 2018, vol. 54, # 3, p. 351 - 354,4]

15
[ 350-92-5 ]
[ 55368-42-8 ]
C₁₆H₁₀BrF₃N₂O [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
94%	With potassium <i>tert</i>-butylate In N,N-dimethyl-formamide at 70℃; for 12h;	11 Example 11 A method for synthesizing a 5-trifluoromethyl-4H-imidazolin-4-one derivative, comprising the steps of: In an air atmosphere, in a 25 ml reaction flask equipped with a reflux condenser, 0.2 mmol of 4-bromobenzamidine hydrochloride, 0.5 mmol of potassium t-butoxide, 0.4 mmol of 3-phenyl-1,1,1,-trifluoroacetone, 2 ml of N,N-dimethylformamide were added, the reaction system was stirred at 70 ° C for 12 hours, the heating and stirring were stopped, the mixture was cooled to room temperature, water was added, and the reaction mixture was extracted with ethyl acetate. The ethyl acetate layer was evaporated under reduced pressure to remove solvent and then purified by column chromatography. The target product was obtained. The column chromatography eluent used was a petroleum ether:ethyl acetate mixture solvent in a volume ratio of 10:1; the yield of the product was 94%.

Reference： [1]Current Patent Assignee: SOUTH CHINA UNIVERSITY OF TECHNOLOGY - CN108976170, 2018, A Location in patent: Paragraph 0086-0096

16
[ 55368-42-8 ]
[ 146137-79-3 ]
C₂₇H₁₆N₄O [ No CAS ]

Reference： [1]Patent: CN109293583,2019,A

17
[ 55368-42-8 ]
[ 1895-39-2 ]
[ 51721-68-7 ]
2-(4-bromophenyl)-4-(4-methoxyphenyl)-1,3,5-triazine [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
45%	With caesium carbonate; In acetonitrile; at 120℃; for 24h;	The reaction bottle by adding 1 b (4 mmol), two chlorofluorcarbons sodium acetate (4 mmol), cesium carbonate (8 mmol) and acetonitrile (10 ml), then in 120 C heating reaction 24 hours. After the reaction is finished using water quenching, and then the extraction of ethyl acetate, the combined organic phase after drying with anhydrous sodium sulfate, concentrated using petroleum ether and ethyl acetate mixed solvent of column chromatography to obtain the product 3 b, yield is 76%. White solid

Reference： [1]Patent: CN109810069,2019,A .Location in patent: Paragraph 0097-0099

18
[ 55368-42-8 ]
[ 1895-39-2 ]
[ 156732-93-3 ]

Yield	Reaction Conditions	Operation in experiment
77%	With caesium carbonate In acetonitrile at 120℃; for 24h;	14 The reaction bottle by adding 1 b (4 mmol), two chlorofluorcarbons sodium acetate (4 mmol), cesium carbonate (8 mmol) and acetonitrile (10 ml), then in 120 °C heating reaction 24 hours. After the reaction is finished using water quenching, and then the extraction of ethyl acetate, the combined organic phase after drying with anhydrous sodium sulfate, concentrated using petroleum ether and ethyl acetate mixed solvent of column chromatography to obtain the product 3 b, yield is 76%. White solid
77%	With caesium carbonate In acetonitrile at 120℃; for 24h; Schlenk technique;

Reference： [1]Current Patent Assignee: ZHENGZHOU UNIVERSITY OF LIGHT INDUSTRY - CN109810069, 2019, A Location in patent: Paragraph 0058-0060
[2]Yan, Yizhe; Cui, Chang; Wang, Jianyong; Li, Shaoqing; Tang, Lin; Liu, Yanqi [Organic and Biomolecular Chemistry, 2019, vol. 17, # 35, p. 8071 - 8074]

19
[ 667-27-6 ]
[ 55368-42-8 ]
[ 51721-68-7 ]
2,4-bis(4-methoxyphenyl)-1,3,5-triazine [ No CAS ]
2-(4-bromophenyl)-4-(4-methoxyphenyl)-1,3,5-triazine [ No CAS ]

Reference： [1]Chemical Communications,2019,vol. 55,p. 8079 - 8082

20
[ 33757-48-1 ]
[ 55368-42-8 ]
[ 83800-88-8 ]

Yield	Reaction Conditions	Operation in experiment
89%	With copper diacetate; potassium carbonate In dimethyl sulfoxide at 110℃; Sealed tube;

Reference： [1]Ban, Zihui; Cui, Xinfeng; Hu, Fangpeng; Lu, Guoqiang; Luo, Nan; Huang, Guosheng [New Journal of Chemistry, 2019, vol. 43, # 33, p. 12963 - 12966]

21
[ 55368-42-8 ]
[ 2366135-35-3 ]
[ 1911641-83-2 ]

Yield	Reaction Conditions	Operation in experiment
35%	Stage #1: 4-bromobenzamidine hydrochloride salt With sodium hydrogencarbonate; 2,2,4,4,6,6-hexamethylcyclotrisilazane In 5,5-dimethyl-1,3-cyclohexadiene at 100℃; for 1h; Inert atmosphere; Stage #2: N-(4-phenylbenzoyl)benzamidine In 5,5-dimethyl-1,3-cyclohexadiene at 150℃; for 6h;	1-24 Example 1-24 4-Bromobenzamidine hydrochloride under argon atmosphere(18.8 g, 80 mmol) xylene (600 mL)It was suspended in. To this suspension was added sodium bicarbonate (6.72 g, 80 mmol) and hexamethylcyclotrisilazane.(38.1 mL, 160 mmol) was added,Stir at 100 ° C. for 1 hour. The reaction mixture was then added to N- (4-phenylbenzoyl) benzamidine(24.0 g, 80 mmol)Stir at 150 ° C. for 6 hours. After cooling to room temperature,The low boiling point component was distilled off under reduced pressure, water was added to the residue, and the solid was collected by filtration.Washed with water, methanol and then hexane.The obtained solid was repeatedly purified by recrystallization (xylene, then toluene) to give a white solid.2- (1,1 '-[biphenyl] -4-yl) -4- (4-bromophenyl) -6-phenyl-1,3,5-triazine was obtained.(13.1 g, 35%).

Reference： [1]Current Patent Assignee: SAGAMI CHEMICAL RESEARCH INSTITUTE; TOSOH CORPORATION - JP2019/131500, 2019, A Location in patent: Paragraph 0157; 0158

22
[ 2975-46-4 ]
[ 55368-42-8 ]
[ 210354-17-9 ]

Yield	Reaction Conditions	Operation in experiment
58%	With potassium carbonate; In dichloromethane; at 20℃; for 3h;	General procedure: A mixture of ynal 1 (0.5 mmol), amidine hydrochloride 2 (0.6 mmol), K2CO3(1.0 mmol), and MCM-41-PPh3-AuCl (41 mg, 0.015 mmol) in DCM (3mL) was stirred at room temperature for 3 h (TLC monitored). The resulting mixture was then diluted with ethyl acetate (15 mL) and filtered. The gold catalyst was washed with distilled water(5 mL), and dry ethanol (25mL) and reused in the next run. The filtrate was concentrated under reduced pressure and the residue was purified by chromatography on silicagel (eluent: petroleum ether/ethyl acetate) to afford the desired product 3.

Reference： [1]Synthetic Communications,2019,vol. 49,p. 2488 - 2500

23
[ 55368-42-8 ]
[ 1895-39-2 ]
[ 51721-68-7 ]
2-(4-bromophenyl)-4-(4-methoxyphenyl)-1,3,5-triazine [ No CAS ]
[ 156732-93-3 ]

Reference： [1]Organic and Biomolecular Chemistry,2019,vol. 17,p. 8071 - 8074

Same Skeleton Products

Related Products

Historical Records

Related Functional Groups of
[ 55368-42-8 ]

Aryls

[ 16796-52-4 ]

3-Bromobenzimidamide hydrochloride

Similarity: 0.98

[ 22265-36-7 ]

4-Bromobenzimidamide

Similarity: 0.98

[ 26177-44-6 ]

(4-Bromophenyl)methanamine hydrochloride

Similarity: 0.81

[ 3959-07-7 ]

4-Bromobenzylamine

Similarity: 0.79

[ 1171381-49-9 ]

(4-Bromo-2-methylphenyl)methanamine hydrochloride

Similarity: 0.77

Bromides

[ 16796-52-4 ]

3-Bromobenzimidamide hydrochloride

Similarity: 0.98

[ 22265-36-7 ]

4-Bromobenzimidamide

Similarity: 0.98

[ 26177-44-6 ]

(4-Bromophenyl)methanamine hydrochloride

Similarity: 0.81

[ 3959-07-7 ]

4-Bromobenzylamine

Similarity: 0.79

[ 1171381-49-9 ]

(4-Bromo-2-methylphenyl)methanamine hydrochloride

Similarity: 0.77

Amidines

[ 16796-52-4 ]

3-Bromobenzimidamide hydrochloride

Similarity: 0.98

[ 22265-36-7 ]

4-Bromobenzimidamide

Similarity: 0.98

[ 1670-14-0 ]

Benzimidamide hydrochloride

Similarity: 0.76

[ 6326-27-8 ]

4-Methylbenzimidamide hydrochloride

Similarity: 0.76

[ 20680-59-5 ]

3-Methylbenzimidamide hydrochloride

Similarity: 0.76

Amines

[ 16796-52-4 ]

3-Bromobenzimidamide hydrochloride

Similarity: 0.98

[ 22265-36-7 ]

4-Bromobenzimidamide

Similarity: 0.98

[ 26177-44-6 ]

(4-Bromophenyl)methanamine hydrochloride

Similarity: 0.81

[ 3959-07-7 ]

4-Bromobenzylamine

Similarity: 0.79

[ 1171381-49-9 ]

(4-Bromo-2-methylphenyl)methanamine hydrochloride

Similarity: 0.77

Ghs Precautionary Statements

Precautionary Statements-General
Code	Phrase
P101	If medical advice is needed,have product container or label at hand.
P102	Keep out of reach of children.
P103	Read label before use
Prevention
Code	Phrase
P201	Obtain special instructions before use.
P202	Do not handle until all safety precautions have been read and understood.
P210	Keep away from heat/sparks/open flames/hot surfaces. - No smoking.
P211	Do not spray on an open flame or other ignition source.
P220	Keep/Store away from clothing/combustible materials.
P221	Take any precaution to avoid mixing with combustibles
P222	Do not allow contact with air.
P223	Keep away from any possible contact with water, because of violent reaction and possible flash fire.
P230	Keep wetted
P231	Handle under inert gas.
P232	Protect from moisture.
P233	Keep container tightly closed.
P234	Keep only in original container.
P235	Keep cool
P240	Ground/bond container and receiving equipment.
P241	Use explosion-proof electrical/ventilating/lighting/equipment.
P242	Use only non-sparking tools.
P243	Take precautionary measures against static discharge.
P244	Keep reduction valves free from grease and oil.
P250	Do not subject to grinding/shock/friction.
P251	Pressurized container: Do not pierce or burn, even after use.
P260	Do not breathe dust/fume/gas/mist/vapours/spray.
P261	Avoid breathing dust/fume/gas/mist/vapours/spray.
P262	Do not get in eyes, on skin, or on clothing.
P263	Avoid contact during pregnancy/while nursing.
P264	Wash hands thoroughly after handling.
P265	Wash skin thouroughly after handling.
P270	Do not eat, drink or smoke when using this product.
P271	Use only outdoors or in a well-ventilated area.
P272	Contaminated work clothing should not be allowed out of the workplace.
P273	Avoid release to the environment.
P280	Wear protective gloves/protective clothing/eye protection/face protection.
P281	Use personal protective equipment as required.
P282	Wear cold insulating gloves/face shield/eye protection.
P283	Wear fire/flame resistant/retardant clothing.
P284	Wear respiratory protection.
P285	In case of inadequate ventilation wear respiratory protection.
P231 + P232	Handle under inert gas. Protect from moisture.
P235 + P410	Keep cool. Protect from sunlight.
Response
Code	Phrase
P301	IF SWALLOWED:
P304	IF INHALED:
P305	IF IN EYES:
P306	IF ON CLOTHING:
P307	IF exposed:
P308	IF exposed or concerned:
P309	IF exposed or if you feel unwell:
P310	Immediately call a POISON CENTER or doctor/physician.
P311	Call a POISON CENTER or doctor/physician.
P312	Call a POISON CENTER or doctor/physician if you feel unwell.
P313	Get medical advice/attention.
P314	Get medical advice/attention if you feel unwell.
P315	Get immediate medical advice/attention.
P320
P302 + P352	IF ON SKIN: wash with plenty of soap and water.
P321
P322
P330	Rinse mouth.
P331	Do NOT induce vomiting.
P332	IF SKIN irritation occurs:
P333	If skin irritation or rash occurs:
P334	Immerse in cool water/wrap n wet bandages.
P335	Brush off loose particles from skin.
P336	Thaw frosted parts with lukewarm water. Do not rub affected area.
P337	If eye irritation persists:
P338	Remove contact lenses, if present and easy to do. Continue rinsing.
P340	Remove victim to fresh air and keep at rest in a position comfortable for breathing.
P341	If breathing is difficult, remove victim to fresh air and keep at rest in a position comfortable for breathing.
P342	If experiencing respiratory symptoms:
P350	Gently wash with plenty of soap and water.
P351	Rinse cautiously with water for several minutes.
P352	Wash with plenty of soap and water.
P353	Rinse skin with water/shower.
P360	Rinse immediately contaminated clothing and skin with plenty of water before removing clothes.
P361	Remove/Take off immediately all contaminated clothing.
P362	Take off contaminated clothing and wash before reuse.
P363	Wash contaminated clothing before reuse.
P370	In case of fire:
P371	In case of major fire and large quantities:
P372	Explosion risk in case of fire.
P373	DO NOT fight fire when fire reaches explosives.
P374	Fight fire with normal precautions from a reasonable distance.
P376	Stop leak if safe to do so. Oxidising gases (section 2.4) 1
P377	Leaking gas fire: Do not extinguish, unless leak can be stopped safely.
P378
P380	Evacuate area.
P381	Eliminate all ignition sources if safe to do so.
P390	Absorb spillage to prevent material damage.
P391	Collect spillage. Hazardous to the aquatic environment
P301 + P310	IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician.
P301 + P312	IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.
P301 + P330 + P331	IF SWALLOWED: Rinse mouth. Do NOT induce vomiting.
P302 + P334	IF ON SKIN: Immerse in cool water/wrap in wet bandages.
P302 + P350	IF ON SKIN: Gently wash with plenty of soap and water.
P303 + P361 + P353	IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower.
P304 + P312	IF INHALED: Call a POISON CENTER or doctor/physician if you feel unwell.
P304 + P340	IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing.
P304 + P341	IF INHALED: If breathing is difficult, remove victim to fresh air and keep at rest in a position comfortable for breathing.
P305 + P351 + P338	IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
P306 + P360	IF ON CLOTHING: Rinse Immediately contaminated CLOTHING and SKIN with plenty of water before removing clothes.
P307 + P311	IF exposed: call a POISON CENTER or doctor/physician.
P308 + P313	IF exposed or concerned: Get medical advice/attention.
P309 + P311	IF exposed or if you feel unwell: call a POISON CENTER or doctor/physician.
P332 + P313	IF SKIN irritation occurs: Get medical advice/attention.
P333 + P313	IF SKIN irritation or rash occurs: Get medical advice/attention.
P335 + P334	Brush off loose particles from skin. Immerse in cool water/wrap in wet bandages.
P337 + P313	IF eye irritation persists: Get medical advice/attention.
P342 + P311	IF experiencing respiratory symptoms: call a POISON CENTER or doctor/physician.
P370 + P376	In case of fire: Stop leak if safe to Do so.
P370 + P378	In case of fire:
P370 + P380	In case of fire: Evacuate area.
P370 + P380 + P375	In case of fire: Evacuate area. Fight fire remotely due to the risk of explosion.
P371 + P380 + P375	In case of major fire and large quantities: Evacuate area. Fight fire remotely due to the risk of explosion.
Storage
Code	Phrase
P401
P402	Store in a dry place.
P403	Store in a well-ventilated place.
P404	Store in a closed container.
P405	Store locked up.
P406	Store in corrosive resistant/ container with a resistant inner liner.
P407	Maintain air gap between stacks/pallets.
P410	Protect from sunlight.
P411
P412	Do not expose to temperatures exceeding 50 oC/ 122 oF.
P413
P420	Store away from other materials.
P422
P402 + P404	Store in a dry place. Store in a closed container.
P403 + P233	Store in a well-ventilated place. Keep container tightly closed.
P403 + P235	Store in a well-ventilated place. Keep cool.
P410 + P403	Protect from sunlight. Store in a well-ventilated place.
P410 + P412	Protect from sunlight. Do not expose to temperatures exceeding 50 oC/122oF.
P411 + P235	Keep cool.
Disposal
Code	Phrase
P501	Dispose of contents/container to ...
P502	Refer to manufacturer/supplier for information on recovery/recycling

Purity	Size	Price	VIP Price	USA Stock *0-1 Day	Global Stock *5-7 Days	Quantity
{[ item.p_purity ]}	{[ item.pr_size ]}	{[ getRatePrice(item.pr_usd, 1,1) ]} {[ getRatePrice(item.pr_usd,item.pr_rate,item.mem_rate) ]}	{[ getRatePrice(item.pr_usd, 1,1) ]}	Inquiry {[ getRatePrice(item.pr_usd,item.pr_rate,item.mem_rate) ]} {[ getRatePrice(item.pr_usd,1,item.mem_rate) ]}	{[ item.pr_usastock ]}	Inquiry -	{[ item.pr_chinastock ]}	Inquiry -

Physical hazards
Code	Phrase
H200	Unstable explosive
H201	Explosive; mass explosion hazard
H202	Explosive; severe projection hazard
H203	Explosive; fire, blast or projection hazard
H204	Fire or projection hazard
H205	May mass explode in fire
H220	Extremely flammable gas
H221	Flammable gas
H222	Extremely flammable aerosol
H223	Flammable aerosol
H224	Extremely flammable liquid and vapour
H225	Highly flammable liquid and vapour
H226	Flammable liquid and vapour
H227	Combustible liquid
H228	Flammable solid
H229	Pressurized container: may burst if heated
H230	May react explosively even in the absence of air
H231	May react explosively even in the absence of air at elevated pressure and/or temperature
H240	Heating may cause an explosion
H241	Heating may cause a fire or explosion
H242	Heating may cause a fire
H250	Catches fire spontaneously if exposed to air
H251	Self-heating; may catch fire
H252	Self-heating in large quantities; may catch fire
H260	In contact with water releases flammable gases which may ignite spontaneously
H261	In contact with water releases flammable gas
H270	May cause or intensify fire; oxidizer
H271	May cause fire or explosion; strong oxidizer
H272	May intensify fire; oxidizer
H280	Contains gas under pressure; may explode if heated
H281	Contains refrigerated gas; may cause cryogenic burns or injury
H290	May be corrosive to metals
Health hazards
Code	Phrase
H300	Fatal if swallowed
H301	Toxic if swallowed
H302	Harmful if swallowed
H303	May be harmful if swallowed
H304	May be fatal if swallowed and enters airways
H305	May be harmful if swallowed and enters airways
H310	Fatal in contact with skin
H311	Toxic in contact with skin
H312	Harmful in contact with skin
H313	May be harmful in contact with skin
H314	Causes severe skin burns and eye damage
H315	Causes skin irritation
H316	Causes mild skin irritation
H317	May cause an allergic skin reaction
H318	Causes serious eye damage
H319	Causes serious eye irritation
H320	Causes eye irritation
H330	Fatal if inhaled
H331	Toxic if inhaled
H332	Harmful if inhaled
H333	May be harmful if inhaled
H334	May cause allergy or asthma symptoms or breathing difficulties if inhaled
H335	May cause respiratory irritation
H336	May cause drowsiness or dizziness
H340	May cause genetic defects
H341	Suspected of causing genetic defects
H350	May cause cancer
H351	Suspected of causing cancer
H360	May damage fertility or the unborn child
H361	Suspected of damaging fertility or the unborn child
H361d	Suspected of damaging the unborn child
H362	May cause harm to breast-fed children
H370	Causes damage to organs
H371	May cause damage to organs
H372	Causes damage to organs through prolonged or repeated exposure
H373	May cause damage to organs through prolonged or repeated exposure
Environmental hazards
Code	Phrase
H400	Very toxic to aquatic life
H401	Toxic to aquatic life
H402	Harmful to aquatic life
H410	Very toxic to aquatic life with long-lasting effects
H411	Toxic to aquatic life with long-lasting effects
H412	Harmful to aquatic life with long-lasting effects
H413	May cause long-lasting harmful effects to aquatic life
H420	Harms public health and the environment by destroying ozone in the upper atmosphere

[ CAS No. 55368-42-8 ] {[proInfo.proName]}

Quality Control of [ 55368-42-8 ]

Related Doc. of [ 55368-42-8 ]

Product Details of [ 55368-42-8 ]

Calculated chemistry of [ 55368-42-8 ]

Physicochemical Properties

Pharmacokinetics

Lipophilicity

Druglikeness

Water Solubility

Medicinal Chemistry

Safety of [ 55368-42-8 ]

Application In Synthesis of [ 55368-42-8 ]

[ 55368-42-8 ] Synthesis Path-Upstream 1~5

[ 55368-42-8 ] Synthesis Path-Downstream 1~23

Related Functional Groups of [ 55368-42-8 ]

Aryls

Bromides

Amidines

Amines

Precautionary Statements-General

Prevention

Response

Storage

Disposal

Physical hazards

Health hazards

Environmental hazards

Inquiry

Related Functional Groups of
[ 55368-42-8 ]