4-(Cyanomethyl)benzoic acid ethyl ester

Modify Date: 2025-08-24 14:17:35

4-(Cyanomethyl)benzoic acid ethyl ester Structure
4-(Cyanomethyl)benzoic acid ethyl ester structure
Common Name 4-(Cyanomethyl)benzoic acid ethyl ester
CAS Number 83901-88-6 Molecular Weight 189.21100
Density 1.112 Boiling Point 325.971ºC at 760 mmHg
Molecular Formula C11H11NO2 Melting Point N/A
MSDS N/A Flash Point 153.252ºC

 Names

Name Ethyl 4-(cyanomethyl)benzoate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.112
Boiling Point 325.971ºC at 760 mmHg
Molecular Formula C11H11NO2
Molecular Weight 189.21100
Flash Point 153.252ºC
Exact Mass 189.07900
PSA 50.09000
LogP 1.92938
Storage condition 2-8°C

 Safety Information

HS Code 2926909090

 Synthetic Route

~83%

4-(Cyanomethyl)benzoic acid ethyl ester Structure

4-(Cyanomethyl)...

CAS#:83901-88-6

Literature: Wu, Lingyun; Hartwig, John F. Journal of the American Chemical Society, 2005 , vol. 127, # 45 p. 15824 - 15832

~42%

4-(Cyanomethyl)benzoic acid ethyl ester Structure

4-(Cyanomethyl)...

CAS#:83901-88-6

Literature: Boehringer Ingelheim International GmbH Patent: US2004/242572 A1, 2004 ; Location in patent: Page/Page column 34 ;

~75%

4-(Cyanomethyl)benzoic acid ethyl ester Structure

4-(Cyanomethyl)...

CAS#:83901-88-6

Literature: Shang, Rui; Ji, Dong-Sheng; Chu, Ling; Fu, Yao; Liu, Lei Angewandte Chemie - International Edition, 2011 , vol. 50, # 19 p. 4470 - 4474

~71%

4-(Cyanomethyl)benzoic acid ethyl ester Structure

4-(Cyanomethyl)...

CAS#:83901-88-6

Literature: Velcicky, Juraj; Soicke, Arne; Steiner, Roland; Schmalz, Hans-Guenther Journal of the American Chemical Society, 2011 , vol. 133, # 18 p. 6948 - 6951

~%

4-(Cyanomethyl)benzoic acid ethyl ester Structure

4-(Cyanomethyl)...

CAS#:83901-88-6

Literature: Snyder et al. Journal of the American Chemical Society, 1958 , vol. 80, p. 4622,4624

~%

4-(Cyanomethyl)benzoic acid ethyl ester Structure

4-(Cyanomethyl)...

CAS#:83901-88-6

Literature: Snyder et al. Journal of the American Chemical Society, 1958 , vol. 80, p. 4622,4624

 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

4-Cyanmethyl-benzoesaeure-aethylester
ethyl 4-cyanomethylbenzoate
4-(CYANOMETHYL)BENZOIC ACID ETHYL ESTER
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