3-Bromo-4-methylbenzonitrile

Modify Date: 2024-01-10 07:16:36

3-Bromo-4-methylbenzonitrile Structure
3-Bromo-4-methylbenzonitrile structure
Common Name 3-Bromo-4-methylbenzonitrile
CAS Number 42872-74-2 Molecular Weight 196.044
Density 1.5±0.1 g/cm3 Boiling Point 259.0±20.0 °C at 760 mmHg
Molecular Formula C8H6BrN Melting Point 41-45 °C(lit.)
MSDS Chinese USA Flash Point 110.5±21.8 °C
Symbol GHS07
GHS07
Signal Word Warning

 Names

Name 3-Bromo-4-methylbenzonitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.5±0.1 g/cm3
Boiling Point 259.0±20.0 °C at 760 mmHg
Melting Point 41-45 °C(lit.)
Molecular Formula C8H6BrN
Molecular Weight 196.044
Flash Point 110.5±21.8 °C
Exact Mass 194.968353
PSA 23.79000
LogP 2.60
Vapour Pressure 0.0±0.5 mmHg at 25°C
Index of Refraction 1.591

 Safety Information

Symbol GHS07
GHS07
Signal Word Warning
Hazard Statements H302-H312-H332
Precautionary Statements P280
Personal Protective Equipment dust mask type N95 (US);Eyeshields;Gloves
Hazard Codes Xn:Harmful;
Risk Phrases R20/21/22
Safety Phrases S36
RIDADR UN3439
WGK Germany 3
Packaging Group III
Hazard Class 6.1
HS Code 2926909090

 Synthetic Route

~97%

3-Bromo-4-methylbenzonitrile Structure

3-Bromo-4-methy...

CAS#:42872-74-2

Literature: Cheprakov, A. V.; Makhon'kov, D. I.; Rodkin, M. A.; Beletskaya, I. P. Journal of Organic Chemistry USSR (English Translation), 1988 , vol. 24, # 2 p. 217 - 223 Zhurnal Organicheskoi Khimii, 1988 , vol. 24, # 2 p. 248 - 255

~65%

3-Bromo-4-methylbenzonitrile Structure

3-Bromo-4-methy...

CAS#:42872-74-2

Literature: Angell, Richard M.; Angell, Tony D.; Bamborough, Paul; Brown, David; Brown, Murray; Buckton, Jacky B.; Cockerill, Stuart G.; Edwards, Chris D.; Jones, Katherine L.; Longstaff, Tim; Smee, Penny A.; Smith, Kathryn J.; Somers, Don O.; Walker, Ann L.; Willson, Malcolm Bioorganic and Medicinal Chemistry Letters, 2008 , vol. 18, # 1 p. 324 - 328

~%

3-Bromo-4-methylbenzonitrile Structure

3-Bromo-4-methy...

CAS#:42872-74-2

Literature: Zhang, Yong-Kang; Plattner, Jacob J.; Freund, Yvonne R.; Easom, Eric E.; Zhou, Yasheen; Gut, Jiri; Rosenthal, Philip J.; Waterson, David; Gamo, Francisco-Javier; Angulo-Barturen, Inigo; Ge, Min; Li, Zhiya; Li, Lingchao; Jian, Yong; Cui, Han; Wang, Hailong; Yang, Jian Bioorganic and Medicinal Chemistry Letters, 2011 , vol. 21, # 2 p. 644 - 651

~%

3-Bromo-4-methylbenzonitrile Structure

3-Bromo-4-methy...

CAS#:42872-74-2

Literature: Claus; Kunath Journal fuer Praktische Chemie (Leipzig), 1889 , vol. <2> 39, p. 486

 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

3-Bromo-p-tolunitrile
3-Brom-4-methyl-benzonitril
3-bromo-4-methyl-benzonitrile
3-Brom-p-toluylsaeure-nitril
3-bromo-4-methylbenzenecarbonitrile
MFCD06797818
3-Bromo-4-methylbenzonitrile
Benzonitrile, 3-bromo-4-methyl-
4-METHYL-3-BROMOBENZONITRILE
3-bromo-4-tolunitrile
2-Bromo-4-cyanotoluene