[ CAS No. 25412-53-7 ] {[proInfo.proName]}

Name: 25412-53-7|4-Acetamidobenzylamine|95%
Brand: Ambeed
SKU: A830621
Rating: 93 (28 reviews)

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Quality Control of [ 25412-53-7 ]

COA NMR CNMR HPLC LC-MS

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SDS Specification

Alternatived Products of [ 25412-53-7 ]

Product Details of [ 25412-53-7 ]

CAS No. :	25412-53-7	MDL No. :	MFCD01861391
Formula :	C₉H₁₂N₂O	Boiling Point :	-
Linear Structure Formula :	-	InChI Key :	AWRGRDOODISXNB-UHFFFAOYSA-N
M.W :	164.20	Pubchem ID :	15295869
Synonyms :

Calculated chemistry of [ 25412-53-7 ]

Physicochemical Properties

Num. heavy atoms :	12
Num. arom. heavy atoms :	6
Fraction Csp3 :	0.22
Num. rotatable bonds :	3
Num. H-bond acceptors :	2.0
Num. H-bond donors :	2.0
Molar Refractivity :	48.43
TPSA :	55.12 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) :	-7.17 cm/s

Lipophilicity

Log Po/w (iLOGP) :	1.38
Log Po/w (XLOGP3) :	0.19
Log Po/w (WLOGP) :	0.76
Log Po/w (MLOGP) :	0.96
Log Po/w (SILICOS-IT) :	0.99
Consensus Log Po/w :	0.86

Druglikeness

Lipinski :	0.0
Ghose :	None
Veber :	0.0
Egan :	0.0
Muegge :	1.0
Bioavailability Score :	0.55

Water Solubility

Log S (ESOL) :	-1.15
Solubility :	11.6 mg/ml ; 0.0708 mol/l
Class :	Very soluble
Log S (Ali) :	-0.91
Solubility :	20.4 mg/ml ; 0.124 mol/l
Class :	Very soluble
Log S (SILICOS-IT) :	-2.82
Solubility :	0.248 mg/ml ; 0.00151 mol/l
Class :	Soluble

Medicinal Chemistry

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

Safety of [ 25412-53-7 ]

Signal Word:	Danger	Class:	8
Precautionary Statements:	P260-P264-P270-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P363-P405-P501	UN#:	3259
Hazard Statements:	H302-H314	Packing Group:	Ⅲ
GHS Pictogram:

Application In Synthesis of [ 25412-53-7 ]

* 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.

Downstream synthetic route of [ 25412-53-7 ]

[ 25412-53-7 ] Synthesis Path-Downstream 1~39

1
[ 25412-53-7 ]
[ 122-85-0 ]

Reference： [1]Journal of the Chemical Society. Perkin transactions II,1988,p. 1015 - 1020
[2]Bulletin of the Chemical Society of Japan,1988,vol. 61,p. 3717 - 3722

2
[ 4403-71-8 ]
[ 108-24-7 ]
[ 25412-53-7 ]

Reference： [1]Journal of Organic Chemistry,1994,vol. 59,p. 1095 - 1101

3
[ 4403-71-8 ]
[ 108-24-7 ]
[ 25412-53-7 ]
[ 99362-10-4 ]

Reference： [1]Journal of Organic Chemistry,1994,vol. 59,p. 1095 - 1101

4
[ 25412-53-7 ]
[ 27048-04-0 ]
[ 91941-10-5 ]

Reference： [1]Journal of Medicinal Chemistry,1994,vol. 37,p. 3016 - 3022

5
[ 5153-67-3 ]
[ 25412-53-7 ]
N-{4-[(2-Nitro-1-phenyl-ethylamino)-methyl]-phenyl}-acetamide [ No CAS ]

Reference： [1]Canadian Journal of Chemistry,1996,vol. 74,p. 625 - 629

6
[ 5153-67-3 ]
[ 25412-53-7 ]
C₁₇H₁₈N₃O₃^(1-)*H⁽¹⁺⁾ [ No CAS ]

Reference： [1]Canadian Journal of Chemistry,1996,vol. 74,p. 625 - 629

7
[ 25412-53-7 ]
[ 2025-40-3 ]
3-(4-Acetylamino-benzylamino)-2-cyano-3-phenyl-propionic acid ethyl ester [ No CAS ]

Reference： [1]International Journal of Chemical Kinetics,1996,vol. 28,p. 165 - 170

8
[ 3695-95-2 ]
[ 25412-53-7 ]
C₂₄H₂₁N₄O₃^(1-)*H⁽¹⁺⁾ [ No CAS ]

Reference： [1]Journal of Chemical Research, Miniprint,1997,p. 2358 - 2377

9
[ 2700-22-3 ]
[ 25412-53-7 ]
<i>N</i>-{4-[(2,2-dicyano-1-phenyl-ethylamino)-methyl]-phenyl}-acetamide [ No CAS ]

Reference： [1]International Journal of Chemical Kinetics,1999,vol. 31,p. 245 - 252

11
[ 25412-53-7 ]
[ 177947-84-1 ]
4-(4-acetylaminophenyl)methylamino-1-[3-(5-(1,2,4-triazol-4-yl)-1H-indol-3-yl)propyl]piperidine [ No CAS ]

Reference： [1]Journal of Medicinal Chemistry,1999,vol. 42,p. 4981 - 5001

12
[ 25412-53-7 ]
<i>N</i>-(4-iminomethyl-phenyl)-acetamide [ No CAS ]

Reference： [1]Indian Journal of Chemistry, Section A: Inorganic, Physical, Theoretical and Analytical,2002,vol. 41,p. 541 - 546
[2]Journal of the Indian Chemical Society,2004,vol. 81,p. 935 - 941

13
[ 25412-53-7 ]
[ 162012-71-7 ]
[ 1027158-05-9 ]

Reference： [1]Chemical and Pharmaceutical Bulletin,2002,vol. 50,p. 1073 - 1080

14
[ 25412-53-7 ]
[ 70-34-8 ]
C₁₅H₁₄N₄O₅ [ No CAS ]

Reference： [1]Bioorganic and Medicinal Chemistry Letters,2007,vol. 17,p. 5652 - 5655

15
[ 25412-53-7 ]
C₁₅H₁₂N₄O₄ [ No CAS ]

Reference： [1]Bioorganic and Medicinal Chemistry Letters,2007,vol. 17,p. 5652 - 5655

16
[ 389602-62-4 ]
[ 25412-53-7 ]
[ 68957-94-8 ]
[ 389601-56-3 ]

Yield	Reaction Conditions	Operation in experiment
38%	With 4-methyl-morpholine; In dichloromethane;	EXAMPLE 50 N-(4-acetylamino-phenylmethyl)-3-(4'-trifluoromethylbiphenyl-2-carbonylamino)-benzoic acid amide Prepared analogously to Example 7 from 3-(4'-trifluoromethylbiphenyl-2-carbonylamino)-benzoic acid and 4-acetylaminobenzylamine in dichloromethane with the addition of propanephosphonic acid cycloanhydride and N-methylmorpholine. Yield:38% of theory Rf value:0.60 (silica gel; dichloromethane/ethanol=9:1)

Reference： [1]Patent: US2002/32238,2002,A1

17
[ 25412-53-7 ]
[ 140-88-5 ]
C₁₄H₂₀N₂O₃ [ No CAS ]

Reference： [1]Bioorganic and Medicinal Chemistry Letters,2008,vol. 18,p. 1623 - 1627

18
[ 25412-53-7 ]
[ 1061862-41-6 ]

Yield	Reaction Conditions	Operation in experiment
		Example 5 N-[4-(acetylamino)benzyl]-4-[(trifluoromethyl)thio]benzamide The product was prepared from <strong>[25412-53-7]N-(4-(aminomethyl)phenyl)acetamide</strong> according to Method A: 1H NMR (500 MHz, DMSO-d6) delta ppm 2.03 (s, 3 H), 4.44 (d, J=5.2 Hz, 2 H), 7.21 - 7.29 (m, J=8.8 Hz, 2 H), 7.47 - 7.53 (m, J=8.5 Hz, 2 H), 7.80 - 7.85 (m, J=8.2 Hz, 2 H), 7.92 - 8.01 (m, J=8.5 Hz, 2 H), 9.23 (t, J=6.0 Hz, 1 H); MS (ESI+) m/z 369.0 (M+H)+.

Reference： [1]Patent: EP2119476,2009,A2

19
C₁₇H₂₁N₃O₃S [ No CAS ]
[ 25412-53-7 ]
C₂₅H₂₉N₅O₄ [ No CAS ]

Reference： [1]Molecules,2013,vol. 18,p. 5706 - 5722

20
[ 35704-19-9 ]
[ 25412-53-7 ]

Yield	Reaction Conditions	Operation in experiment
90%		The R-N02 or R-CN (1 mmol), G-NiPd catalyst (4mg), and water:methanol (3:7) were stirred 5 mm in a 100 mL thermolysis tube at room temperature. Next, AS (3 mmol) was added to the reaction mixture and the vessel was closed. Reaction was then continued under vigorous stirring at room temperature. The progress of the catalytic reaction was monitored by thin layered chromatography (TLC). Most reactions completed over the time period of 5-30 mi Afier completion of the reaction, the catalysts were removed by centrifugation at 7000 rpm and washed three times with water or methanol. Then, the catalysts were allowed to dry for further uses. The solvent was removed by using a rotary evaporatot Finally, the crude residue was directly purified by colunm chromatography on silica gel using acetone. The yields of the reduced compounds were determined by ?H and ?3C NMR with D20, DM50, CD3OD or CDC13 as the solvent depending on the product separated.

Reference： [1]ChemSusChem,2017,vol. 10,p. 842 - 846
[2]ACS Catalysis,2014,vol. 4,p. 1777 - 1782
[3]Patent: US2016/279619,2016,A1 .Location in patent: Paragraph 0022
[4]ChemCatChem,2016,vol. 8,p. 1329 - 1334
[5]Catalysis science and technology,2014,vol. 4,p. 629 - 632
[6]Journal of Organic Chemistry,2019,vol. 84,p. 11604 - 11611

21
(R)-1-(1-(naphthalen-1-yl)ethyl)piperidine-4-carboxylic acid [ No CAS ]
[ 25412-53-7 ]
[ 1581755-38-5 ]

Reference： [1]Journal of Medicinal Chemistry,2014,vol. 57,p. 2393 - 2412

22
C₁₀H₉ClN₄ [ No CAS ]
[ 25412-53-7 ]
N-(4-(((2-(methylamino)-6-(pyridin-2-yl)pyrimidin-4-yl)amino)methyl)phenyl)acetamide [ No CAS ]

Reference： [1]ACS Medicinal Chemistry Letters,2014,vol. 5,p. 1114 - 1118

23
2,4-dichloro-6-(pyridin-2-yl)pyrimidine [ No CAS ]
[ 25412-53-7 ]
N-(4-(((2-(methylamino)-6-(pyridin-2-yl)pyrimidin-4-yl)amino)methyl)phenyl)acetamide [ No CAS ]

Reference： [1]ACS Medicinal Chemistry Letters,2014,vol. 5,p. 1114 - 1118

24
2,4-dichloro-6-(pyridin-2-yl)pyrimidine [ No CAS ]
[ 25412-53-7 ]
C₁₈H₁₆ClN₅O [ No CAS ]

Reference： [1]ACS Medicinal Chemistry Letters,2014,vol. 5,p. 1114 - 1118

25
[ 25412-53-7 ]
C₂₃H₁₉ClF₃N₃O₅S [ No CAS ]

Reference： [1]Bioorganic and Medicinal Chemistry Letters,2014,vol. 24,p. 5364 - 5368

26
[ 25412-53-7 ]
C₂₂H₁₇ClF₃N₃O₅S [ No CAS ]

Reference： [1]Bioorganic and Medicinal Chemistry Letters,2014,vol. 24,p. 5364 - 5368

27
[ 25412-53-7 ]
[ 69812-51-7 ]
C₁₇H₁₈N₂O₅S [ No CAS ]

Reference： [1]Bioorganic and Medicinal Chemistry Letters,2014,vol. 24,p. 5364 - 5368

28
C₁₅H₉BCl₂F₂N₃Pol [ No CAS ]
[ 25412-53-7 ]
C₂₄H₂₀BF₂N₈OPol [ No CAS ]

Reference： [1]Angewandte Chemie - International Edition,2015,vol. 54,p. 2442 - 2446
Angew. Chem.,2015,vol. 127,p. 2472 - 2476,5

29
[ 25412-53-7 ]
[ 2949-22-6 ]
ethyl ((4-acetamidobenzyl)carbamoyl)glycinate [ No CAS ]

Reference： [1]Journal of Medicinal Chemistry,2016,vol. 59,p. 2596 - 2611

30
[ 25412-53-7 ]
[ 145013-05-4 ]
N-(4-((3-tert-butoxycarbonylthioureido)methyl)phenyl)acetamide [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
		Step 3: N-(4-((3-tert-butoxycarbonylthioureido)methyl)phenyl)acetamide (1242) (1243) To a mixture of N,N?-bis-tert-butoxycarbonylthiourea (500 mg, 1.81 mmol) and anhydrous THF (20 mL) was added 60% NaH (87 mg, 2.17 mmol) at 0 C. The reaction mixture was stirred at 14-17 oC for 1 h, then TFAA (193 mg/0.129 mL, 1.99 mmol) was added and the stirring continued for an additional 1 h. Then, N-(4- (aminomethyl)phenyl)acetamide (249 mg, 1.99 mmol) and Et3N (1 mL) in anhydrous THF (10 mL) was added and the resulting reaction was stirred at 14-17 oC for 18 h. H2O (50 mL) was added to quench the reaction and the mixture was extracted with EtOAc (3 × 50 mL). The combined organic layers were washed with brine (2 × 40 mL), dried over with anhydrous Na2SO4, filtered, and the filtrate was concentrated under reduced pressure. The residue was purified by flash column chromatography (ISCO) on silica gel (eluting with petroleum ether: EtOAc =1:0 to 10:1) to afford N-(4-((3-tert- butoxycarbonyl thioureido)methyl)phenyl)acetamide as a white solid. (1244) LCMS Method C: Rt = 0.998 min; (M+Na)+ = 346.2.

Reference： [1]Patent: WO2017/214367,2017,A1 .Location in patent: Page/Page column 347-348

31
[ 25412-53-7 ]
2-((4-(3-(4-acetamidobenzyl)-2-amino-4-oxo-1,3,7-triazaspiro[4.4]non-1-en-7-yl)pyrimidin-5-yl)oxy)-5-fluoro-N-isopropyl-N-methylbenzamide [ No CAS ]

Reference： [1]Patent: WO2017/214367,2017,A1

32
[ 25412-53-7 ]
tert-butyl 3-(4-acetamidobenzyl)-2-((tert-butoxycarbonyl)amino)-4-oxo-1,3,7-triazaspiro[4.4]non-1-ene-7-carboxylate [ No CAS ]

Reference： [1]Patent: WO2017/214367,2017,A1

33
[ 25412-53-7 ]
N-(4-((2-amino-4-oxo-1,3,7-triazaspiro[4.4]non-1-en-3-yl)methyl)phenyl)acetamide [ No CAS ]

Reference： [1]Patent: WO2017/214367,2017,A1

34
[ 1253778-94-7 ]
[ 25412-53-7 ]

Yield	Reaction Conditions	Operation in experiment
93%	With sulfuric acid; at 25℃; for 3h;	General procedure: A solution of 2a (0.3 mmol) in conc. H2SO4 (3 mL) was stirred at 25 C for 3 h under air. Then the mixture was poured into water (25 mL) and extracted with ethyl acetate (3 * 15 mL). The combined organic layer was dried (Na2SO4) and filtered over Celite, evaporated in vacuo. The residue was purified by column chromatography (ethyl acetate/hexane) to afford the pure product.

Reference： [1]Tetrahedron,2018,vol. 74,p. 1085 - 1091

35
[ 25412-53-7 ]
[ 15999-95-8 ]
C₂₃H₂₃N₃O [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	With 1,3-dimethyl-3,4,5,6-tetrahydro-2(1H)-pyrimidinone; at 80℃;Molecular sieve;	General procedure: A solution of N-arylbenzamide (0.5 mmol) in thionyl chloride (3 mL) was heated at 85 C in a closed vial overnight, then was evaporated to dryness. Toluene (3 mL) was added and the solvent was evaporated off to yield the crude iminochloride. The resultant residue was taken up in DMPU (2 mL); activated powdered molecular sieves (300 mg) and the benzylic amine (0.75 mmol) were added and the mixture was heated at 80 C for 1 h, then cooled to rt. Hexafluorobenzene (2 mL) was then added, followed by silver (II) oxide (3 mmol) and the resultant mixture was heated at 100 C overnight. The mixture was filtered through a plug of Celite using DCM to aid the transfer and washing of solids, and the combined organics were concentrated under reduced pressure. The resultant residue was purified by silica gel chromatography to afford the pure 2,4-diarylquinazoline.

Reference： [1]Tetrahedron Letters,2018,vol. 59,p. 2368 - 2371

36
[ 25412-53-7 ]
2,3-dihydro-1H-benzo[f]chromen-3-ol [ No CAS ]
N-(4-[(2,3-dihydro-1H-benzo[f]chromen-3-yl)amino]-methyl}phenyl)acetamide [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
77%	In methanol at 20℃; for 2h;	Synthesis of 2-aminochromanes and their benzoanalogs 3a-r, 4a,b, 5, 6 a-c, 7 (General method) General procedure: Chromanol2a-f (1 mmol) was dissolved in MeOH (5 ml), and amine(1 mmol) was added to the resulting solution. The solutionwas kept at room temperature for 2 h (unless otherwisespecified), then at -30° for 1 h. The formed precipitatewas filtered off, washed with ice-cold MeOH, and recrystallized.

Reference： [1]Klimochkin, Yuri N.; Korzhenko, Kirill S.; Osipov, Dmitry V.; Osyanin, Vitaly А.; Semenova, Irina А. [Chemistry of Heterocyclic Compounds, 2020, vol. 56, # 3, p. 311 - 319][Khim. Geterotsikl. Soedin., 2020, vol. 56, # 3, p. 311 - 319,9]

37
[ 122-85-0 ]
[ 25412-53-7 ]

Yield	Reaction Conditions	Operation in experiment
84%	With ammonia; hydrogen In methanol at 30℃; for 24h; Autoclave;

Reference： [1]Xie, Chao; Song, Jinliang; Hua, Manli; Hu, Yue; Huang, Xin; Wu, Haoran; Yang, Guanying; Han, Buxing [ACS Catalysis, 2020, vol. 10, # 14, p. 7763 - 7772]

38
[ 25412-53-7 ]
C₂₂H₂₂N₂O₇ [ No CAS ]
(8S)-N-[(4-acetamidophenyl)methyl]-7-{2-[(4-phenoxyphenyl)formamido]acetyl}-1,4-dioxa-7-azaspiro[4.4]nonane-8-carboxamide [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	With N-ethyl-N,N-diisopropylamine; HATU In N,N-dimethyl-formamide at 20℃; for 1h; Inert atmosphere;	1 Scheme 4. Synthesis of Compound 16 - Compound 27 To a stirring mixture of the in situ generated GlyPro peptide (S4 Intermediate) in DMF (140 vols) (containing excess Hiinigs base) was added l-[bis(dimethylamino)methylene]-lH-l,2,3- triazolo[4,5-b]pyridinium 3-oxid hexafluoro phosphate (1.0 equiv) and an amine nucleophile (1.0 equiv) in a single combined portion. The mixture was allowed to stir at room temperature for 1 hour. The mixture was directly purified via reverse phase HPLC to afford the desired coupled product after concentration of the appropriate fractions.(8S)-N-(3-Carbamimidoylpropyl)-7-{2-[(4-phenoxyphenyl)formamido]acetyl}-l,4-dioxa-7- azaspiro[4.4]nonane-8-carboxamide (Compound 16): (8S)-N-(3-Carbamimidoylpropyl)-7-{2- [(4-phenoxyphenyl)formamido]acetyl}-l,4-dioxa-7-azaspiro[4.4]nonane-8-carboxamide was prepared according to Scheme 4 with the use of 4-aminobutanimidamide dihydrochloride as the amine nucleophile. NMR (400 MHz, Methanol-d4) d 7.94 - 7.84 (m, 2H), 7.49 - 7.39 (m, 2H), 7.23 (t, J = 7.5 Hz, 1H), 7.12 - 6.99 (m, 4H), 4.51 (dd, J = 8.9, 6.2 Hz, 1H), 4.26 (d, J = 16.7 Hz, 1H), 4.09 (d, J = 16.7 Hz, 1H), 4.03 (s, 4H), 3.96 - 4.02 (m, 1H), 3.86 - 3.77 (m, 2H), 3.30 - 3.28(m, 1H), 2.61 - 2.34 (m, 3H), 2.21 (dd, J = 13.1, 6.3 Hz, 1H), 1.94 - 1.87 (m, 2H).

Reference： [1]Current Patent Assignee: ASTRAZENECA PLC - WO2020/198062, 2020, A1 Location in patent: Page/Page column 288-289; 292

39
[ 25412-53-7 ]
1-(1H-benzo[f]chromen-2-yl)-2,2,2-trifluoroethan-1-one [ No CAS ]
(E)-N-(4-[({4,4,4-trifluoro-2-[(2-hydroxynaphthalen-1-yl)methyl]-3-oxobut-1-en-1-yl}amino)-methyl]phenyl)acetamide [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
81%	In methanol at 20℃; for 8h; diastereoselective reaction;	Enamino ketones 2b-2m (general procedure). General procedure: Chromene 1a or 1b, 1 mmol, was dispersed in 3 mL ofmethanol, 1 mmol of the corresponding primary aminewas added with stirring, and the mixture was stirred atroom temperature for 8 h. The initial chromene graduallydissolved, and the product began to precipitate.The mixture was kept at -30°C for 2 h, and the precipitatewas filtered off, washed with 1 mL of ice-coldmethanol, and purified by recrystallization. If noproduct precipitated, the solvent was distilled off underreduced pressure, and the residue was recrystallizedfrom an appropriate solvent.

Reference： [1]Osyanin; Korzhenko; Rashchepkina; Osipov; Klimochkin, Yu. N. [Russian Journal of Organic Chemistry, 2021, vol. 57, # 7, p. 1053 - 1062][Zh. Org. Khim., 2021, vol. 57, # 7, p. 949 - 960]

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Code	Phrase
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Prevention
Code	Phrase
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P222	Do not allow contact with air.
P223	Keep away from any possible contact with water, because of violent reaction and possible flash fire.
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P231	Handle under inert gas.
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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

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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. 25412-53-7 ] {[proInfo.proName]}

Quality Control of [ 25412-53-7 ]

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Product Details of [ 25412-53-7 ]

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Physicochemical Properties

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Lipophilicity

Druglikeness

Water Solubility

Medicinal Chemistry

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Application In Synthesis of [ 25412-53-7 ]

[ 25412-53-7 ] Synthesis Path-Downstream 1~39

Related Functional Groups of [ 25412-53-7 ]

Aryls

Amides

Amines

Precautionary Statements-General

Prevention

Response

Storage

Disposal

Physical hazards

Health hazards

Environmental hazards

Inquiry

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[ 25412-53-7 ]