[ CAS No. 65610-14-2 ] {[proInfo.proName]}

Name: 65610-14-2|4-Fluorophthalonitrile|97%
Brand: Ambeed
SKU: A160877
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Quality Control of [ 65610-14-2 ]

COA NMR CNMR HPLC LC-MS

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SDS Specification

Alternatived Products of [ 65610-14-2 ]

Product Details of [ 65610-14-2 ]

CAS No. :	65610-14-2	MDL No. :	MFCD00210430
Formula :	C₈H₃FN₂	Boiling Point :	-
Linear Structure Formula :	-	InChI Key :	QQEKYCCJLSRLEC-UHFFFAOYSA-N
M.W :	146.12	Pubchem ID :	103423
Synonyms :

Calculated chemistry of [ 65610-14-2 ]

Physicochemical Properties

Num. heavy atoms :	11
Num. arom. heavy atoms :	6
Fraction Csp3 :	0.0
Num. rotatable bonds :	0
Num. H-bond acceptors :	3.0
Num. H-bond donors :	0.0
Molar Refractivity :	35.83
TPSA :	47.58 Å²

Pharmacokinetics

GI absorption :	High
BBB permeant :	Yes
P-gp substrate :	No
CYP1A2 inhibitor :	Yes
CYP2C19 inhibitor :	No
CYP2C9 inhibitor :	No
CYP2D6 inhibitor :	No
CYP3A4 inhibitor :	No
Log Kp (skin permeation) :	-6.05 cm/s

Lipophilicity

Log Po/w (iLOGP) :	1.38
Log Po/w (XLOGP3) :	1.61
Log Po/w (WLOGP) :	1.99
Log Po/w (MLOGP) :	1.2
Log Po/w (SILICOS-IT) :	2.19
Consensus Log Po/w :	1.67

Druglikeness

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

Water Solubility

Log S (ESOL) :	-2.16
Solubility :	1.0 mg/ml ; 0.00686 mol/l
Class :	Soluble
Log S (Ali) :	-2.22
Solubility :	0.878 mg/ml ; 0.00601 mol/l
Class :	Soluble
Log S (SILICOS-IT) :	-2.83
Solubility :	0.218 mg/ml ; 0.00149 mol/l
Class :	Soluble

Medicinal Chemistry

PAINS :	0.0 alert
Brenk :	0.0 alert
Leadlikeness :	1.0
Synthetic accessibility :	1.69

Safety of [ 65610-14-2 ]

Signal Word:	Danger	Class:	6.1
Precautionary Statements:	P501-P270-P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313-P301+P310+P330-P405	UN#:	3439
Hazard Statements:	H300-H315+H320	Packing Group:	Ⅱ
GHS Pictogram:

Application In Synthesis of [ 65610-14-2 ]

* 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 [ 65610-14-2 ]
Downstream synthetic route of [ 65610-14-2 ]

[ 65610-14-2 ] Synthesis Path-Upstream 1~2

1
[ 31643-49-9 ]
[ 65610-14-2 ]

Reference： [1] Tetrahedron Letters, 2008, vol. 49, # 3, p. 449 - 454

2
[ 557-21-1 ]
[ 2369-37-1 ]
[ 65610-14-2 ]

Reference： [1] Synlett, 2008, # 15, p. 2287 - 2290

[ 65610-14-2 ] Synthesis Path-Downstream 1~42

Yield	Reaction Conditions	Operation in experiment
	Diamid (IV), POCl3;

2
[ 401564-31-6 ]
[ 65610-14-2 ]
[ 401565-01-3 ]

Yield	Reaction Conditions	Operation in experiment
1.08 g	With N-ethyl-N,N-diisopropylamine In 1-methyl-pyrrolidin-2-one at 80℃; for 4h;
	With N-ethyl-N,N-diisopropylamine In 1-methyl-pyrrolidin-2-one	59.1 Synthesis of 3-[(2S,4S)-4-(3,4-dicyanophenyl)amino-2-pyrrolidinylcarbonyl]-1,3-thiazolidine hydrochloride (1) The title compound (0.904 g) of Reference Example 10, diisopropylethylamine (1.57 mL) and 4-fluorophthalonitrile (0.438 g) were dissolved in N-methyl-2-pyrrolidone (9 mL), and the mixture was stirred at 80°C for 4 hr. The reaction mixture was poured into saturated aqueous sodium hydrogencarbonate solution, and the mixture was extracted with ethyl acetate. The extract was dried and the solvent was evaporated under reduced pressure. The residue was purified by silica gel chromatography to give 3-[(2S,4S)-1-tert-butoxycarbonyl-4-(3,4-dicyanophenyl)amino-2-pyrrolidinylcarbonyl]-1,3-thiazolidine (1.08 g) as white amorphous.

Reference： [1]Sakashita, Hiroshi; Akahoshi, Fumihiko; Kitajima, Hiroshi; Tsutsumiuchi, Reiko; Hayashi, Yoshiharu [Bioorganic and Medicinal Chemistry, 2006, vol. 14, # 11, p. 3662 - 3671]
[2]Current Patent Assignee: MITSUBISHI CHEMICAL HOLDINGS CORPORATION - EP1308439, 2003, A1

3
[ 507237-50-5 ]
[ 65610-14-2 ]
[ 507239-61-4 ]

Yield	Reaction Conditions	Operation in experiment
		38 4-(2-Methyl-4-pyrrolidin-1-yl-quinolin-7-ylmethoxy)-phthalonitrile Example 38 4-(2-Methyl-4-pyrrolidin-1-yl-quinolin-7-ylmethoxy)-phthalonitrile The title compound was produced in accordance with the general method of example 6 from (2-methyl-4-pyrrolidin-1-yl-quinolin-7-yl)-methanol (example 2) and 4-fluorophthalonitrile. Light yellow solid, ISP-MS: m/e=369.3 ([M+H]+).

Reference： [1]Current Patent Assignee: ROCHE HOLDING AG - US2003/158179, 2003, A1

4
[ 507237-46-9 ]
[ 65610-14-2 ]
[ 507241-16-9 ]

Yield	Reaction Conditions	Operation in experiment
		68.a (S)-4-[4-(2-Hydroxymethyl-pyrrolidin-1-yl)-2-methyl-quinolin-7-ylmethoxy]-phthalonitrile a) 4-(4-Chloro-2-methyl-quinolin-7-ylmethoxy)-phthalonitrile. The title compound was produced in accordance with the general method of example 54a from (4-chloro-2-methyl-quinolin-7-yl)-methanol (example 2c) and 4-fluorophthalonitrile. White foam, ISP-MS: m/e=334.2 ([M+H]+).

Reference： [1]Current Patent Assignee: ROCHE HOLDING AG - US2003/158179, 2003, A1

5
[ 31643-49-9 ]
[ 65610-14-2 ]

Yield	Reaction Conditions	Operation in experiment
87%	With tris(dimethylamino)methylium trifluoromethanolate In acetonitrile at 20℃; for 12h;
	Multi-step reaction with 2 steps 1.1: palladium 10% on activated carbon; hydrogen / ethanol / Heating 2.1: nitrosonium tetrafluoroborate / chloroform / 20 °C 2.2: Heating

Reference： [1]Kolomeitsev, Alexander A.; Vorobyev, Mikhail; Gillandt, Hartmut [Tetrahedron Letters, 2008, vol. 49, # 3, p. 449 - 454]
[2]Platonova, Yana B.; Tomilova, Larisa G.; Volov, Alexander N. [Journal of Catalysis, 2020, vol. 391, p. 224 - 228]

6
[ 61-54-1 ]
[ 65610-14-2 ]
[ 1018699-99-4 ]

Yield	Reaction Conditions	Operation in experiment
35%	In ethanol at 20℃; for 25h;	17 General Procedure for the Synthesis of N-(3,4-dicyanophenyl)-tryptamine Under an argon atmosphere, a 100 ml three-necked round-bottom flask was charged with tryptamine (1.10 g, 1 equiv.) dissolved in EtOH (12 ml). To the solution 4-fluoro-phtahalonitrile (1.00 g, 1 equiv.) was then added in one portion. The resulting mixture was allowed to react under magnetic stirring for 25 h at room temperature. The reaction course was followed by TLC and HPLC-MS. The solvent was then removed by rotary evaporation and the crude product was chromatographed over a silica gel column by eluting with dichloromethane. The product was recovered as an off-white solid (880 mg, yield 35%).1H NMR (CDCl3, 400 MHz) δ 3.13 (t, J=6.3 Hz, 2H, CH2CH2NH), 3.51-3.56 (m, 2H, CH2CH2NH), 4.54 (br t, J=5.3 Hz, 1H, CH2CH2NH), 6.69 (dd, J1=2.3 Hz, J2=8.6 Hz, 1H, aromatic H), 6.79 (d, J=2.5 Hz, 1H, aromatic H), 7.06 (d, J=2.3 Hz, 1H, aromatic H), 7.14-7.18 (m, 1H, aromatic H), 7.23-7.27 (m, 1H, aromatic H), 7.41 (br d, J=8.1 Hz, 1H, aromatic H), 7.46 (d, J=8.8 Hz, 1H, aromatic H), 7.57 (br d, J=8.1 Hz, 1H, aromatic H), 8.08 (br s, 1H, NH).

Reference： [1]Current Patent Assignee: NEURIM PHARMACEUTICALS 1991 - US2008/132559, 2008, A1 Location in patent: Page/Page column 8-9

7
[ 608-07-1 ]
[ 65610-14-2 ]
[ 1018700-03-2 ]

Yield	Reaction Conditions	Operation in experiment
22%	In ethanol at 20℃; for 20h;	18 General Procedure for the Synthesis of N-(3,4-dicyanophenyl)-5-methoxytryptamine Under an argon atmosphere, a 100 ml three-necked round bottom flask was charged with 5-methoxytryptamine (1.33 g, 1 equiv.) dissolved in hot EtOH (20 ml). The solution was then cooled to room temperature and 4-fluoro-phtahalonitrile (1.00 g, 1 equiv.), was added in one portion. The resulting mixture was allowed to react under magnetic stirring for 20 h at room temperature. The reaction course was followed by TLC and HPLC-MS. The solvent was then removed by rotary evaporation and the crude product was chromatographed over a silica gel column by eluting with dichloromethane. The product was recovered as a white solid (490 mg, yield 22%).1H NMR (CDCl3, 400 MHz) δ 3.09 (t, J=6.6 Hz, 2H, CH2CH2NH), 3.50-3.54 (m, 2H, CH2CH2NH), 3.85 (s, 3H, OCH3), 4.55 (br t, J=5.1 Hz, 1H, CH2CH2NH), 6.69 (dd, J1=2.3 Hz, J2=8.8 Hz, 1H, aromatic H), 6.80 (d, J=2.8 Hz, 1H, aromatic H), 6.90 (dd, J1=2.0 Hz, J2=8.8 Hz, 1H, aromatic H), 6.98 (d, J=2.9 Hz, 1H, aromatic H), 7.03 (d, J=2.3 Hz, 1H, aromatic H), 7.30 (d, J=8.8 Hz, 1H, aromatic H), 7.47 (d, J=8.8 Hz, 1H, aromatic H), 7.97 (br s, 1H, NH).

Reference： [1]Current Patent Assignee: NEURIM PHARMACEUTICALS 1991 - US2008/132559, 2008, A1 Location in patent: Page/Page column 9

8
[ 65610-14-2 ]
[ 557-34-6 ]
[ 1120355-27-2 ]

Yield	Reaction Conditions	Operation in experiment
45%	In further solvent(s) under N2, C6H3F(CN)2 (3.4 mmol) and Zn(CH3COO)2 (0.94 mmol) in 1-chloronaphthalene heated for 20 h under reflux; deluted with MeOH, stirred for 1 h, washed (MeOH, then DMF), ppt. filtered, washed (MeOH), dried at 150°C in vac., purified by sublimation in vac. at 350°C;

Reference： [1]Brinkmann; Kelting; Makarov; Tsaryova; Schnurpfeil; Woehrle; Schlettwein [Physica Status Solidi (A) Applications and Materials, 2008, vol. 205, # 3, p. 409 - 420]

9
[ 557-21-1 ]
[ 2369-37-1 ]
[ 65610-14-2 ]

Yield	Reaction Conditions	Operation in experiment
87%	With (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride; tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; polymethylhydroxysilane In N,N-dimethyl acetamide at 100℃; for 2h;

Reference： [1]Location in patent: experimental part Iqbal, Zafar; Lyubimtsev, Alexey; Hanack, Michael [Synlett, 2008, # 15, p. 2287 - 2290]

10
[ 65610-14-2 ]
[ 1242238-87-4 ]

Yield	Reaction Conditions	Operation in experiment
	With hydrazine hydrate In ethanol at 80℃; for 4h;

Reference： [1]Location in patent: experimental part Meyers, Marvin J.; Arhancet, Graciela B.; Hockerman, Susan L.; Chen, Xiangyang; Long, Scott A.; Mahoney, Matthew W.; Rico, Joseph R.; Garland, Danny J.; Blinn, James. R.; Collins, Joe T.; Yang, Shengtian; Huang, Horng-Chih; McGee, Kevin F.; Wendling, Jay M.; Dietz, Jessica D.; Payne, Maria A.; Homer, Bruce L.; Heron, Marcia I.; Reitz, David B.; Hu, Xiao [Journal of Medicinal Chemistry, 2010, vol. 53, # 16, p. 5979 - 6002]

11
[ 65610-14-2 ]
[ 121-33-5 ]
[ 893786-32-8 ]

Yield	Reaction Conditions	Operation in experiment
62%	With potassium carbonate In N,N-dimethyl-formamide at 95℃; for 5h;

Reference： [1]Location in patent: experimental part Patch, Raymond J.; Searle, Lily L.; Kim, Alexander J.; De, Debyendu; Zhu, Xizhen; Askari, Hossein B.; O'Neill, John C.; Abad, Marta C.; Rentzeperis, Dionisios; Liu, Jianying; Kemmerer, Michael; Lin, Ling; Kasturi, Jyotsna; Geisler, John G.; Lenhard, James M.; Player, Mark R.; Gaul, Micheal D. [Journal of Medicinal Chemistry, 2011, vol. 54, # 3, p. 788 - 808]

12
[ 65610-14-2 ]
[ 121-33-5 ]
[ 1262328-56-2 ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 2 steps 1: potassium carbonate / N,N-dimethyl-formamide / 5 h / 95 °C 2: sodium acetate / acetonitrile / 105 °C

Reference： [1]Patch, Raymond J.; Searle, Lily L.; Kim, Alexander J.; De, Debyendu; Zhu, Xizhen; Askari, Hossein B.; O'Neill, John C.; Abad, Marta C.; Rentzeperis, Dionisios; Liu, Jianying; Kemmerer, Michael; Lin, Ling; Kasturi, Jyotsna; Geisler, John G.; Lenhard, James M.; Player, Mark R.; Gaul, Micheal D. [Journal of Medicinal Chemistry, 2011, vol. 54, # 3, p. 788 - 808]

13
[ 4747-21-1 ]
[ 65610-14-2 ]
3,4-dicyano-(N-methyl-N-isopropyl)aniline [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	at 100℃; for 0.05h; Microwave irradiation;

Reference： [1]Location in patent: experimental part Galievsky, Victor A.; Druzhinin, Sergey I.; Demeter, Attila; Kovalenko, Sergey A.; Senyushkina, Tamara; Mayer, Peter; Zachariasse, Klaas A. [Journal of Physical Chemistry A, 2011, vol. 115, # 40, p. 10823 - 10845]

14
tert-butyl (1r,3r)-3-hydroxy-2,2,4,4-tetramethylcyclobutylcarbamate [ No CAS ]
[ 65610-14-2 ]
C₂₁H₂₇N₃O₃ [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	Stage #1: tert-butyl (1r,3r)-3-hydroxy-2,2,4,4-tetramethylcyclobutylcarbamate With sodium hydride In tetrahydrofuran at 10 - 20℃; Stage #2: 4-fluorophthalonitrile In tetrahydrofuran at 10℃; Reflux; Inert atmosphere;

Reference： [1]Location in patent: experimental part Guo, Chuangxing; Linton, Angelica; Kephart, Susan; Ornelas, Martha; Pairish, Mason; Gonzalez, Javier; Greasley, Samantha; Nagata, Asako; Burke, Benjamin J.; Edwards, Martin; Hosea, Natilie; Kang, Ping; Hu, Wenyue; Engebretsen, Jon; Briere, David; Shi, Manli; Gukasyan, Hovik; Richardson, Paul; Dack, Kevin; Underwood, Toby; Johnson, Patrick; Morell, Andrew; Felstead, Robert; Kuruma, Hidetoshi; Matsimoto, Hiroaki; Zoubeidi, Amina; Gleave, Martin; Los, Gerrit; Fanjul, Andrea N. [Journal of Medicinal Chemistry, 2011, vol. 54, # 21, p. 7693 - 7704]

15
CH₄*C₁₃H₂₅NO₃ [ No CAS ]
[ 65610-14-2 ]
C₂₁H₂₇N₃O₃ [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	Stage #1: CH₄*C₁₃H₂₅NO₃ With sodium hydride In tetrahydrofuran at 10 - 20℃; Stage #2: 4-fluorophthalonitrile In tetrahydrofuran at 10℃; Reflux; Inert atmosphere;

Reference： [1]Linton, Angelica; Kang, Ping; Ornelas, Martha; Kephart, Susan; Hu, Qiyue; Pairish, Mason; Jiang, Ying; Guo, Chuangxing [Journal of Medicinal Chemistry, 2011, vol. 54, # 21, p. 7705 - 7712]

16
[ 65610-14-2 ]
4-(3-amino-2,2,4,4-tetramethylcyclobutoxy)phthalonitrile [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 2 steps 1.1: sodium hydride / tetrahydrofuran / 10 - 20 °C 1.2: 10 °C / Reflux; Inert atmosphere 2.1: hydrogenchloride / 1,4-dioxane / 5 - 20 °C

17
[ 65610-14-2 ]
N-[trans-3-(3,4-dicyanophenoxy)-2,2,4,4-tetramethylcyclobutyl]imidazo[1,2-a]pyrimidine-3-carboxamide [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 3 steps 1.1: sodium hydride / tetrahydrofuran / 10 - 20 °C 1.2: 10 °C / Reflux; Inert atmosphere 2.1: hydrogenchloride / 1,4-dioxane / 5 - 20 °C 3.1: O-(1H-benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium hexafluorophosphate; triethylamine / N,N-dimethyl-formamide / 2.5 h / 20 °C

18
[ 65610-14-2 ]
N-[trans-3-(3,4-dicyanophenoxy)-2,2,4,4-tetramethylcyclobutyl]-2-methylimidazo[1,2-a]pyrimidine-3-carboxamide [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 3 steps 1.1: sodium hydride / tetrahydrofuran / 10 - 20 °C 1.2: 10 °C / Reflux; Inert atmosphere 2.1: hydrogenchloride / 1,4-dioxane / 5 - 20 °C 3.1: O-(1H-benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium hexafluorophosphate; triethylamine / N,N-dimethyl-formamide / 2.5 h / 20 °C

19
[ 65610-14-2 ]
[ 1427185-37-2 ]
5-(3,4-dicyanophenoxy)-N-(9-ethyl-9H-carbazol-3-yl)-3-methylpentanamide [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
51%	Stage #1: N-(9-ethyl-9H-carbazol-3-yl)-5-hydroxy-3-methylpentanamide With potassium <i>tert</i>-butylate In N,N-dimethyl-formamide at 10 - 35℃; for 0.25h; Inert atmosphere; Stage #2: 4-fluorophthalonitrile In N,N-dimethyl-formamide at 10 - 35℃; for 14h;	55 5-(3,4-dicyanophenoxy)-N-(9-ethyl-9H-carbazol-3-yl)-3-methylpentanamide Example 55 5-(3,4-dicyanophenoxy)-N-(9-ethyl-9H-carbazol-3-yl)-3-methylpentanamide To a solution of N-(9-ethyl-9H-carbazol-3-yl)-5-hydroxy-3-methylpentanamine (0.40 g, 1.23 mmol) in DMF (10.0 mL) was added potassium-t-butoxide (0.304 g, 2.71 mmol) under argon atmosphere. The mixture was stirred at room temperature for 15 min, and 4-fluorophthalonitrile (0.270 g, 1.85 mmol) was added thereto. The reaction solution was stirred at room temperature for 14 hr, and ethyl acetate (100 mL) was added thereto. The organic layer was washed with cold water (225 mL) and saturated brine (225 mL), and dried, and the solvent was evaporated under reduced pressure. The obtained residue was purified by preparative HPLC to give the title compound (0.285 g, 51%) as a white powder. 1H-NMR(300MHz,DMSO-d6): δ0.99(3H,d,J=5.9Hz), 1.26(3H,t,J=7.0Hz), 1.64-1.69(1H,m), 1.83-1.88(1H,m), 2.21-2.25(2H,m), 2.37-2.39(1H,m), 4.18-4.21(2H,m), 4.37(2H,q,J=6.8Hz), 7.13(1H,t,J=7.2Hz), 7.38-7.43(2H,m), 7.49-7.55(3H,m), 7.74(1H,d,J=2.20Hz), 7.99(2H,t,J=9.2Hz), 8.34(1H,s), 9.86(1H,brs). purification condition by preparative HPLC equipment: Waters Semi-Preparative HPLC instrument

Reference： [1]Current Patent Assignee: TAKEDA PHARMACEUTICAL COMPANY LIMITED - EP2759533, 2014, A1 Location in patent: Paragraph 0532; 0533

20
[ 65610-14-2 ]
C₃₄H₂₂BF₃N₆O [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 2 steps 1: boron trichloride / para-xylene / 0.25 h / 150 °C / Inert atmosphere 2: toluene / 100 °C / Inert atmosphere

Reference： [1]Guilleme, Julia; Martnez-Fernndez, Lara; Gonzlez-Rodrguez, David; Corral, Ins; Yez, Manuel; Torres, Toms [Journal of the American Chemical Society, 2014, vol. 136, # 40, p. 14289 - 14298]

21
[ 65610-14-2 ]
C₂₄H₉BClF₃N₆ [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
16%	With boron trichloride In para-xylene at 150℃; for 0.25h; Inert atmosphere;

22
[ 65610-14-2 ]
C₂₄H₉BBrF₃N₆ [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
12%	With boron tribromide In dichloromethane; toluene at 110℃; for 0.5h; Inert atmosphere;

23
[ 65610-14-2 ]
[ 90-13-1 ]
chloroaluminum tetrafluorophthalocyanine [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
95.9%	With aluminum (III) chloride; urea at 210 - 255℃; for 3h;	Preparation of Chloroaluminum tetrafluorophthalocyanine: Into a 100mL three neck round bottom flask was placed a magnetic stir bar, 20 grams 1-chloronaphthalene, 0.12 grams(2 mmoles) urea, 9.13grams (62.5 mmoles) 4-fluorophthalonitrile, then 2.0 grams (15 mmoles) aluminum trichloride and finally 20 grams of 1-chloronaphthalene was used to wash the funnel. The flask was fitted with thermometer and condenser with nitrogen inlet. The reaction was heated with a heating mantle with continuous magnetic stirring. The reaction mixture gradually darkened until some blue-green color is noted at approximately 210 °C. At the temperature of 210 °C the reaction became exothermic and rapidly heated to reflux at approximately 255 °C with concomitant deep blue color formation. The reaction was held at 255 °C for 3 hours. After this time a deep blue-black solid had formed and the reaction liquid was brownish which stirred freely. The reaction was cooled to 100 °C, then 60mL of xylene was added and the reaction was stirred for 20 minutes. The mixture was filtered while still warm on a Buchner funnel through Whatman No.54 filter paper and a blue-black precipitate was collected. This precipitate was washed with 50mL of xylene then 100mL of acetone. The filtrate was initially brownish but gradually changed to light blue. The collected solid was placed in a 250mL erlenmyer flask, 50 mL of 5% aqueous NaOH was added and the mixture was stirred magnetically for 20 minutes rapidly. The insoluble material was collected on a Buchner funnel. The collected product was washed with 50mL of acetone then 50mL of ligroin, then dried on the Buchner funnel. The product was placed back in a 250mL erlenmyer flask and 50 mL of 5% aqueous NH4OH was added. This solid is completely non-wetting, that is: the solid remains a completely dry powder on top of the colorless liquid and stirring does not wet the solid. The dry powder was collected on a Buchner funnel. The filtrate was totally colorless. The collected solid was washed with 50mL of distilled water, 100mL of acetone, then dried on the Buchner for 20 minutes. After transfer into a 250mL erlenmyer flask 100mL of acetone was added. The mixture was brought to boiling with stirring on a hot plate, held at boiling for 15 minutes, then filtered through Whatman No.54 filter paper while hot. The filtrate is very light blue. The product was dried on the Buchner funnel for 15 minutes then dried in a vacuum oven at 60 °C overnight. The weight of collected intermediate chloroaluminum tetrafluorophthalocyanine as a deep dark blue powder was 9.3 grams (14.3 mmoles, 95.9% yield). Melting point: > 310 °C.

Reference： [1]Current Patent Assignee: LG DISPLAY CO.,LTD. - EP2361398, 2015, B1 Location in patent: Paragraph 0060; 0061

24
[ 626-64-2 ]
[ 65610-14-2 ]
4-(4-oxopyridin-1(4H)-yl)phthalonitrile [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
92%	With triethylamine In N,N-dimethyl-formamide at 80℃; for 5h; Inert atmosphere;

Reference： [1]Lourenço, Leandro M. O.; Sousa, Andreina; Gomes, Maria C.; Faustino, Maria A. F.; Almeida, Adelaide; Silva, Artur M. S.; Neves, Maria G. P. M. S.; Cavaleiro, José A. S.; Cunha, Ângela; Tomé, João P. C. [Photochemical and Photobiological Sciences, 2015, vol. 14, # 10, p. 1853 - 1863]

25
[ 65610-14-2 ]
4,4'-(6-isobutyl-1,6-dihydrobenzo[1,2-d:4,5-d']bis([1,2,3]triazole)-4,8-diyl)bis(N,N-diphenylaniline) [ No CAS ]
C₅₄H₄₀N₁₀ [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	With potassium carbonate In N,N-dimethyl-formamide for 1h; Heating;	Compound 73 Compound 73 was obtained by reacting Compound 2 with 4-fluorobenzonitrile (2 eq) by heating in DMF for one hour in the presence of potassium carbonate (5 eq). Only benzotriazole-2 isomer was formed.

Reference： [1]Current Patent Assignee: NITTO DENKO CORPORATION - JP2016/509621, 2016, A Location in patent: Paragraph 0309-0310

26
[ 245-37-4 ]
[ 65610-14-2 ]
C₂₇H₁₂N₆ [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	With 18-crown-6 ether; potassium carbonate In N,N-dimethyl-formamide; toluene at 140℃; for 10h;	1-1 4,5-diazofluorene(20 mmol),4-fluorophthalonitrile (22 mmol),18 crown 6 ether (5.15 mmol) and potassium carbonate (24 mmol) were added to a 25 mL three-necked flask,Further, 10 mL of N, N-dimethylformamide and 3 ml of toluene were added,Heated to 140 ° C, reacted for 10 h,The reaction solution was poured into a large amount of ice water, allowed to stand for precipitation, filtered and washed with water to obtain a crude product.The resulting crude product was dissolved in acetonitrile and the resulting solution was filtered,The filtrate is mixed with a large amount of distilled water and allowed to stand,Precipitation of yellow solid,Filtered and washed with water,To give a compound of formula I.

Reference： [1]Current Patent Assignee: LANZHOU UNIVERSITY - CN107033141, 2017, A Location in patent: Paragraph 0051-0055

27
[ 65610-14-2 ]
C₂₇H₁₂N₂O₆ [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 3 steps 1: 18-crown-6 ether; potassium carbonate / N,N-dimethyl-formamide; toluene / 10 h / 140 °C 2: sodium carbonate / ethanol; water / 120 h / 80 °C 3: acetic acid; acetic anhydride / 60 h / 130 °C / Inert atmosphere

Reference： [1]Current Patent Assignee: LANZHOU UNIVERSITY - CN107033141, 2017, A

28
[ 65610-14-2 ]
C₂₇H₁₆N₂O₈ [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 2 steps 1: 18-crown-6 ether; potassium carbonate / N,N-dimethyl-formamide; toluene / 10 h / 140 °C 2: sodium carbonate / ethanol; water / 120 h / 80 °C

Reference： [1]Current Patent Assignee: LANZHOU UNIVERSITY - CN107033141, 2017, A

29
9,9-bis(4-hydroxyphenyl)-4,5-diazafluorene [ No CAS ]
[ 65610-14-2 ]
C₃₉H₂₀N₆O₂ [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
70%	With potassium carbonate In N,N-dimethyl-formamide; toluene at 25 - 80℃; for 10.5h;
	With 15-crown-5; sodium carbonate at 20 - 90℃; for 6.5h; Inert atmosphere;	1.3 Example 1-3 This embodiment provides a compound containing Cardo structure represented by Formula I. The method for preparing the compound includesIncluding: 10 mmol of 9,9-bis-(4-hydroxyphenyl)-4,5-diazaindene, 21 mmol of 4-fluorophthalonitrile,13 mmol of sodium carbonate and 15 crowns of 5 ether were added to a 100 mL three-necked flask and magnetically stirred under a nitrogen atmosphere. After reacting for half an hour at room temperature, the temperature was raised to 90° C., and the reaction was continued for 6 hours. After pouring into ice water, the mixture was precipitated.It is filtered, washed with water and the crude product is recrystallized from ethanol to give the compound of formula I.Suggest an edit

Reference： [1]Deng, Bo; Zhang, Shujiang; Liu, Chang; Li, Wei; Zhang, Xiangdong; Wei, Hua; Gong, Chenliang [RSC Advances, 2018, vol. 8, # 1, p. 194 - 205]
[2]Current Patent Assignee: LANZHOU UNIVERSITY - CN107129494, 2017, A Location in patent: Paragraph 0055-0066

30
[ 65610-14-2 ]
9,9-di[4-(3,4-dicarboxyphenoxy)phenyl]-4,5-diazafluorene [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 2 steps 1: potassium carbonate / N,N-dimethyl-formamide; toluene / 10.5 h / 25 - 80 °C 2: potassium hydroxide / water; ethanol / 50 h / 80 °C
	Multi-step reaction with 2 steps 1: sodium carbonate; 15-crown-5 / 6.5 h / 20 - 90 °C / Inert atmosphere 2: potassium hydroxide / ethanol; water / 24 h / 90 °C

31
[ 65610-14-2 ]
9,9-di[4-(3,4-dicarboxyphenoxy)phenyl]-4,5-diazafluorene dianhydride [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 3 steps 1: potassium carbonate / N,N-dimethyl-formamide; toluene / 10.5 h / 25 - 80 °C 2: potassium hydroxide / water; ethanol / 50 h / 80 °C 3: acetic anhydride / 24 h / Inert atmosphere; Reflux
	Multi-step reaction with 3 steps 1: sodium carbonate; 15-crown-5 / 6.5 h / 20 - 90 °C / Inert atmosphere 2: potassium hydroxide / ethanol; water / 24 h / 90 °C 3: acetic anhydride / 23 h / 135 °C / Inert atmosphere

32
[ 65610-14-2 ]
N-(4-aminophenyl)-N-(4-methoxyphenyl)-1-aminopyrene [ No CAS ]
N,N-bis(4-phthalonitrile)-N'-4-methoxyphenyl-N'-1-aminopyrene-1,4-phenylenediamine [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
89%	With cesium fluoride In dimethyl sulfoxide at 140℃; for 5h; Inert atmosphere;	1 Example 1 Preparation of N,N-bis(4-phthalic anhydride)-N'-4-methoxyphenyl-N'-1-aminoindole-1,4-phenylenediamine, the structural formula of which is as follows: Under nitrogen conditions,To the magnetic stirrer,thermometer,5.8 g (14.0 mmol) of 4-aminophenyl-4'-methoxyphenyl-1-aminoindole was added to a 250 mL three-necked flask of a condenser.4.5 g (30.8 mmol) of 4-fluorophthalonitrile,4.6 g (30.8 mmol) of cesium fluoride,Add 36 ml of dimethyl sulfoxide as solvent.Reacting at 140 ° C for 5 h;It was discharged into ethanol at room temperature, suction filtered, and the cake was recrystallized from glacial acetic acid to give N,N-bis(4-phthalonitrile)-N'-4-methoxyphenyl-N'-1 - aminoguanidine-1,4-phenylenediamine 8.3 g, yield 89%;

Reference： [1]Current Patent Assignee: JILIN UNIVERSITY - CN108929297, 2018, A Location in patent: Paragraph 0158-0159; 0164

33
[ 65610-14-2 ]
N-(4-aminophenyl)-N-(4'-methoxynaphth-1-yl)-2-amino-9,9-dimethylfluorene [ No CAS ]
N,N-bis(4-phthalonitrile)-N'-4-methoxynaphthyl-N'-2-amino-9,9-dimethylfluorene-1,4-phenylenediamine [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
94%	With cesium fluoride In dimethyl sulfoxide at 170℃; for 10h; Inert atmosphere;	2 Example 2 N,N-bis(4-phthalic anhydride)-N'-4-methoxynaphthyl-N'-2-amino-9,9-dimethylindole-1,4-phenylenediamine Preparation, the structural formula is as follows: Under nitrogen conditions,To the magnetic stirrer,thermometer,A 250 mL three-necked flask of a condenser was charged with 7.0 g (15.3 mmol) of 4-aminophenyl-4'-methoxynaphthyl-2-amino-9,9-dimethylindole,5.1 g (35.2 mmol) of 4-fluorophthalonitrile,5.3 g (35.2 mmol) of cesium fluoride,Add 33 ml of dimethyl sulfoxide as solvent.Reacting at 170 ° C for 10 h;The mixture was discharged into ethanol at room temperature, suction filtered, and the filter cake was recrystallized from glacial acetic acid to give N,N-bis(4-phthalonitrile)-N'-4-methoxynaphthyl-N'-2 -amino-9,9-dimethylindole-1,4-phenylenediamine 10.2 g, yield 94%;

Reference： [1]Current Patent Assignee: JILIN UNIVERSITY - CN108929297, 2018, A Location in patent: Paragraph 0168-0169; 0174

34
[ 65610-14-2 ]
N-(4-aminophenyl)-N-(9-anthracenyl)-2-aminoanthracene [ No CAS ]
N,N-bis(4-cyanophenyl)-N'-9-anthracenyl-N'-2-aminoanthracene-1,4-phenylenediamine [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
93%	With cesium fluoride In dimethyl sulfoxide at 135℃; for 24h; Inert atmosphere;	3 Example 3 Preparation of N,N-bis(4-phthalic anhydride)-N'-9-fluorenyl-N'-2-aminoindole-1,4-phenylenediamine, the structural formula of which is as follows: Under nitrogen conditions,To the magnetic stirrer,thermometer,8.0 g (17.4 mmol) of 4-aminophenyl-9-mercapto-2-aminoindole was added to a 250 mL three-necked flask of a condenser.5.8 g (40.0 mmol) of 4-fluorophthalonitrile,6.1 g (40.0 mmol) of cesium fluoride,Then add 61.0 mL of dimethyl sulfoxide,Reacting at 135 ° C for 24 h;Ejected in ethanol at room temperature,Filtering,The filter cake is recrystallized from glacial acetic acid.getN, N- bis (4-cyanophenyl) -N'-9- anthracenyl -N'-2- amino-anthracene-1,4-phenylenediamine11.5 g, yield 93%;

Reference： [1]Current Patent Assignee: JILIN UNIVERSITY - CN108929297, 2018, A Location in patent: Paragraph 0177-0178; 0183

35
[ 65610-14-2 ]
[ 86-74-8 ]
4-(9H-carbazol-9-yl)phthalonitrile [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
62%	Stage #1: 9H-carbazole With potassium <i>tert</i>-butylate In dimethyl sulfoxide at 120℃; Inert atmosphere; Stage #2: 4-fluorophthalonitrile In dimethyl sulfoxide at 160℃; for 2h; Inert atmosphere;	4-(9H-carbazol-9-yl)phthalonitrile (CzPN) A mixture of 9H-carbazole (0.836g, 5.0mmol), tBuOK (0.561g, 5.0mmol), and dimethyl sulfoxide (15mL) was placed in a 100mL round-bottom ask under nitrogen atmosphere.Themixturewasstirredandheatedto120°Cbefore adding a solution of 4-uorophthalonitrile (0.731g, 5.0mmol) in dimethyl sulfoxide (15mL). The reaction mixture was heated to 160°C for 2h. After cooling to room temperature, the solvent was removed under reduced pressure and the mixture was extracted with methylene chloride. The organic extracts were combined, washed with water, and dried over MgSO4. Upon evaporating o the solvent, the crude product was puried by column chromatography on silica gel with petroleum ether/ethyl acetate 20:1 to 5:1 (v/v) to yield CzPN (0.91g, 62%) as a pale-yellow powder. 1H NMR (400MHz, CDCl3,δ): 8.12 (d, J=7.8Hz, 2H), 8.05 (s, 1H), 8.02-7.98 (m, 2H), 7.49-7.43 (m, 4H), 7.37 (ddd, J=8.1, 6.2, 2.1Hz, 2H). 13C NMR (100MHz, CDCl3, δ): 142.8, 139.3, 135.3, 130.7, 130.5, 126.8, 124.5, 122.0, 120.9, 117.9, 115.1, 114.8, 113.0, 109.2. LC-MS ([M+Na]+): 316.08. Anal. calcd for C20H11N3 (%): C 81.89, H 3.78, N 14.33; found: C 81.76, H 4.01, N 14.00.

Reference： [1]Wu, Chao; Zhang, Yaxing; Ma, Dongge; Wang, Qiang [Dyes and Pigments, 2020, vol. 173]

36
[ 65610-14-2 ]
[ 10294-34-5 ]
boron 2,9,16-trifluorosubphthalocyanine chloride [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	In 5,5-dimethyl-1,3-cyclohexadiene Inert atmosphere; Heating;	Boron trifluorosubphthalocyanine chloride To a 25 mL round-bottomed flask was added4-fluorophthalonitrile (0.134 g, 0.92 mmol). The flask was purged with N2, p-xylene (4 mL) wasadded and the flask was heated to 140 C. A solution of BCl3 (1 M in p-xylene, 0.75 mL, 0.75 mmol)was added, resulting in a yellow solution. After approximately five minutes, the solution changedcolor to dark purple. The reaction was stirred for 40 min, after which the solvent was reduced in vacuo.The resulting dark purple solid was dissolved in dichloromethane and filtered through a plug of silicagel. The resulting sample was purified by flash chromatography on silica gel (0-5% ethyl acetategradient in hexane). F3SPc(C3)-Boron 2,9,16-trifluorosubphthalocyanine chloride. First elution, purple solid (0.007 g,0.015 mmol, 4.7% yield). 1H NMR (400 MHz, CDCl3) (ppm): 8.87 (dd, 3H, JH-H(ortho) = 8.7 Hz,JH-F(meta) = 4.7 Hz), 8.53 (dd, 3H, JH-F(ortho) = 8.2 Hz, JH-H(meta) = 2.2 Hz), 7.69 (ddd, 3H, JH-H(ortho) =JH-F(ortho) = 8.7 Hz, JH-H(meta) = 2.3 Hz). 19F NMR (376 MHz, CDCl3) (ppm): 106.74 (m). HR-LCMSAPCI: calcd. for (C24H10BClF3N6) [M + H]+, 485.0701; found, 485.0702. F3SPc(C1)-Boron 2,9,17-trifluorosubphthalocyanine chloride. Second elution, purple solid (0.011 g,0.025 mmol, 7.4% yield). 1H NMR (400 MHz, CDCl3) (ppm): 8.87 (m, 3H), 8.52 (m, 3H), 7.68 (m, 3H).19F NMR (376 MHz, CDCl3) (ppm): 106.60 (m), 106.66 (m), 106.86 (m). HR-LCMS APCI: calcd.for (C24H10BClF3N6) [M + H]+, 485.0701; found, 485.0704.

Reference： [1]Calandrino, Rosemarie L.; McAuliffe, Katherine J.; Dolmage, Lauren E.; Trivedi, Evan R. [Molecules, 2019, vol. 24, # 21]

37
[ 34143-74-3 ]
[ 65610-14-2 ]
C₁₈H₇F₁₇N₂S [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
81%	Stage #1: 1H,1H,2H,2H-Perfluorodecanethiol; 4-fluorophthalonitrile With potassium carbonate In acetone at 60℃; for 16h; Stage #2: With hydrogenchloride In water; acetone

Reference： [1]Yoshinaga, Kosuke; Delage-Laurin, Leo; Swager, Timothy M. [Journal of Porphyrins and Phthalocyanines, 2020, vol. 24, # 8, p. 1074 - 1082]

38
[ 14220-64-5 ]
[ 32703-80-3 ]
[ 65610-14-2 ]
C₄₄H₃₉FN₈Pd [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
25%	With 1,8-diazabicyclo[5.4.0]undec-7-ene In acetonitrile at 170℃; for 12h;

Reference： [1]Platonova, Yana B.; Tomilova, Larisa G.; Volov, Alexander N. [Journal of Catalysis, 2020, vol. 391, p. 224 - 228]

39
[ 136918-14-4 ]
[ 65610-14-2 ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 4 steps 1.1: nitric acid; sulfuric acid 2.1: ammonium hydroxide 3.1: palladium 10% on activated carbon; hydrogen / ethanol / Heating 4.1: nitrosonium tetrafluoroborate / chloroform / 20 °C 4.2: Heating

Reference： [1]Platonova, Yana B.; Tomilova, Larisa G.; Volov, Alexander N. [Journal of Catalysis, 2020, vol. 391, p. 224 - 228]

40
[ 89-40-7 ]
[ 65610-14-2 ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 3 steps 1.1: ammonium hydroxide 2.1: palladium 10% on activated carbon; hydrogen / ethanol / Heating 3.1: nitrosonium tetrafluoroborate / chloroform / 20 °C 3.2: Heating

Reference： [1]Platonova, Yana B.; Tomilova, Larisa G.; Volov, Alexander N. [Journal of Catalysis, 2020, vol. 391, p. 224 - 228]

41
[ 56765-79-8 ]
[ 65610-14-2 ]

Yield	Reaction Conditions	Operation in experiment
70%	Stage #1: 3,4-dicyanoaniline With nitrosonium tetrafluoroborate In chloroform at 20℃; Stage #2: In 1,2-dichloro-benzene Heating;

Reference： [1]Platonova, Yana B.; Tomilova, Larisa G.; Volov, Alexander N. [Journal of Catalysis, 2020, vol. 391, p. 224 - 228]

42
aluminum (III) chloride [ No CAS ]
[ 65610-14-2 ]
6-tert-amylnaphthalene-2,3-dicarbonitrile [ No CAS ]
C₅₉H₅₁AlClFN₈ [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
30.5%	With ammonia In quinoline at 180℃; for 7h;	Manufacturing method of phthalocyanine E-1 Ammonia gas was introduced into a solution of 50 parts of quinoline and 1 part of anhydrous aluminum chloride. 5.6 parts of 6-tert-amylnaphthalene-2,3-dicarbonitrile and 1.1 parts of 4-fluorophthalonitrile were added. The reaction was carried out at 180 ° C. for 7 hours. After cooling this to room temperature Add 200 parts of methanol and 200 parts of 10% aqueous hydrochloric acid solution. The precipitated solid was collected by filtration and washed with 200 parts of water. The crude product was purified using a medium pressure preparative liquid chromatograph (Smart Flash AKROS manufactured by Yamazen). Drying at 80 ° C. gave compound E-1 shown in Table 10 in a yield of 30.5%.

Reference： [1]Current Patent Assignee: TOYO INK SC HOLDINGS COMPANY, LIMITED - JP2021/138938, 2021, A Location in patent: Paragraph 0083; 0085

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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
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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. 65610-14-2 ] {[proInfo.proName]}

Quality Control of [ 65610-14-2 ]

Related Doc. of [ 65610-14-2 ]

Product Details of [ 65610-14-2 ]

Calculated chemistry of [ 65610-14-2 ]

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Lipophilicity

Druglikeness

Water Solubility

Medicinal Chemistry

Safety of [ 65610-14-2 ]

Application In Synthesis of [ 65610-14-2 ]

[ 65610-14-2 ] Synthesis Path-Upstream 1~2

[ 65610-14-2 ] Synthesis Path-Downstream 1~42

Related Functional Groups of [ 65610-14-2 ]

Fluorinated Building Blocks

Aryls

Nitriles

Precautionary Statements-General

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Response

Storage

Disposal

Physical hazards

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Environmental hazards

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[ 65610-14-2 ]