2-phenylethyl 2-cyanoacetate

Modify Date: 2025-09-16 18:08:52

2-phenylethyl 2-cyanoacetate Structure
2-phenylethyl 2-cyanoacetate structure
Common Name 2-phenylethyl 2-cyanoacetate
CAS Number 99842-68-9 Molecular Weight 189.21100
Density N/A Boiling Point N/A
Molecular Formula C11H11NO2 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 2-phenylethyl 2-cyanoacetate
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C11H11NO2
Molecular Weight 189.21100
Exact Mass 189.07900
PSA 50.09000
LogP 1.68598
InChIKey NZMIRLKHMFERSX-UHFFFAOYSA-N
SMILES N#CCC(=O)OCCc1ccccc1

 Synthetic Route

~69%

2-phenylethyl 2-cyanoacetate Structure

2-phenylethyl 2...

CAS#:99842-68-9

Literature: Rodrigues, Nuno; Bennis, Khalil; Vivier, Delphine; Pereira, Vanessa; Chatelain, Franck C.; Chapuy, Eric; Deokar, Hemantkumar; Busserolles, Jerome; Lesage, Florian; Eschalier, Alain; Ducki, Sylvie European Journal of Medicinal Chemistry, 2014 , vol. 75, p. 391 - 402

~40%

2-phenylethyl 2-cyanoacetate Structure

2-phenylethyl 2...

CAS#:99842-68-9

Literature: Magens, Silja; Ertelt, Melanie; Jatsch, Anja; Plietker, Bernd Organic Letters, 2008 , vol. 10, # 1 p. 53 - 56

~%

2-phenylethyl 2-cyanoacetate Structure

2-phenylethyl 2...

CAS#:99842-68-9

Literature: McKusick et al. Journal of the American Chemical Society, 1958 , vol. 80, p. 2806,2808

 Synonyms

cyanoacetic acid 2-phenylethyl ester
phenethyl 2-cyanoacetate
Acetic acid,cyano-,2-phenylethyl ester
cyano-acetic acid phenethyl ester
Cyan-essigsaeure-phenaethylester
2-phenylethyl cyanoacetate
phenethyl cyanoacetate
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