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CAS Number: 210113-91-0
ethyl 2-(3-cyanophenyl)acetate

Structure

ethyl 2-(3-cyanophenyl)acetate
Name: ethyl 2-(3-cyanophenyl)acetate
Synonyms:
General Information
Product Number: 210113910

CAS Registry Number 210113-91-0
Name:
Benzeneacetic acid, 3-​cyano-​, ethyl ester
3-Cyanobenzeneacetic acid ethyl ester

 

Chemical Formula: C11H11NO2
Exact Mass: 189.08
Molecular Weight: 189.21
m/z: 189.08 (100.0%), 190.08 (12.3%)

 

InChI:InChI=1S/C11H11NO2/c1-2-14-11(13)7-9-4-3-5-10(6-9)8-12/h3-6H,2,7H2,1H3

InChI Key:TVYAQKQOSLTGQB-UHFFFAOYSA-N

Canonical SMILES:CCOC(=O)CC1=CC=CC(=C1)C#N

 

Thermal Properties Value Condition Note
Melting Point 50 °C   (1)CAS

Specification

98%

References
  1. (1) Song, Bingrui; Advanced Synthesis & Catalysis 2011, V353(9), P1565-1574 CAPLUS
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