3,5-Bis(trifluoromethyl)benzonitrile

Modify Date: 2024-01-09 17:00:20

3,5-Bis(trifluoromethyl)benzonitrile Structure
3,5-Bis(trifluoromethyl)benzonitrile structure
Common Name 3,5-Bis(trifluoromethyl)benzonitrile
CAS Number 27126-93-8 Molecular Weight 239.117
Density 1.5±0.1 g/cm3 Boiling Point 175.8±35.0 °C at 760 mmHg
Molecular Formula C9H3F6N Melting Point 16°C
MSDS N/A Flash Point 72.8±0.0 °C

 Names

Name 3,5-Bis(trifluoromethyl)benzonitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.5±0.1 g/cm3
Boiling Point 175.8±35.0 °C at 760 mmHg
Melting Point 16°C
Molecular Formula C9H3F6N
Molecular Weight 239.117
Flash Point 72.8±0.0 °C
Exact Mass 239.016968
PSA 23.79000
LogP 3.74
Vapour Pressure 1.1±0.3 mmHg at 25°C
Index of Refraction 1.417

 Safety Information

Hazard Codes Xn:Harmful;
Risk Phrases R20/21/22;R36/37/38
Safety Phrases S23-S26-S28-S37/39-S36/37/39-S36/37
RIDADR 3276
WGK Germany 3
Packaging Group III
Hazard Class 6.1
HS Code 2926909090

 Synthetic Route

~83%

3,5-Bis(trifluoromethyl)benzonitrile Structure

3,5-Bis(trifluo...

CAS#:27126-93-8

Literature: MITSUBISHI GAS CHEMICAL COMPANY, INC. Patent: EP1500641 A1, 2005 ; Location in patent: Page 11 ;

~64%

3,5-Bis(trifluoromethyl)benzonitrile Structure

3,5-Bis(trifluo...

CAS#:27126-93-8

Literature: Eckert, Markus Patent: US2003/18209 A1, 2003 ;

~86%

3,5-Bis(trifluoromethyl)benzonitrile Structure

3,5-Bis(trifluo...

CAS#:27126-93-8

Literature: Schareina, Thomas; Zapf, Alexander; Cotte, Alain; Gotta, Matthias; Beller, Matthias Advanced Synthesis and Catalysis, 2011 , vol. 353, # 5 p. 777 - 780

~64%

3,5-Bis(trifluoromethyl)benzonitrile Structure

3,5-Bis(trifluo...

CAS#:27126-93-8

Literature: Muller, Nikolaus; Magerlein, Wolfgang; Beller, Matthias; Schareina, Thomas; Zapf, Alexander Patent: US2009/62541 A1, 2009 ; Location in patent: Page/Page column 4 ;

~%

3,5-Bis(trifluoromethyl)benzonitrile Structure

3,5-Bis(trifluo...

CAS#:27126-93-8

Literature: Brooner, Rachel E. M.; Brown, Timothy J.; Widenhoefer, Ross A. Angewandte Chemie - International Edition, 2013 , vol. 52, # 24 p. 6259 - 6261 Angew. Chem., 2013 , vol. 125, # 24 p. 6379 - 6381,3

 Customs

HS Code 2926909090
Summary HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

 Synonyms

FXFFR CCN EXFFF
3,5-(bistrifluoromethyl)benzonitrile
Benzonitrile, 3,5-bis(trifluoromethyl)-
3,5-Bis(trifluoromethyl)benzonitrile
MBT-CN
3,5-(CF3)2C6H3CN
MFCD00000379
Bis(3,5-trifluoromethyl)benzonitrile
ditrifluoromethylbenzonitrile
3,5-bis(trifluoromethyl)benzenecarbonitrile
3,5-di(Trifluoromethyl)benzonitrile
EINECS 248-240-7
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