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CAS Number: 61788-30-5
ethyl 2-cyano-2-cyclopentylacetate

Structure

ethyl 2-cyano-2-cyclopentylacetate
Name: ethyl 2-cyano-2-cyclopentylacetate
Synonyms:
General Information
Product Number: 61788305
CAS Registry Number: 61788-30-5
Name:
Cyclopentaneacetic acid, α-​cyano-​, ethyl ester
Ethyl 2-​cyclopentyl 2-​cyanoacetate 
 
Chemical Formula: C10H15NO2
Exact Mass: 181.11
Molecular Weight: 181.23
m/z: 181.11 (100.0%), 182.11 (11.3%)
Elemental Analysis: C, 66.27; H, 8.34; N, 7.73; O, 17.66
 
InChI: InChI=1S/C10H15NO2/c1-2-13-10(12)9(7-11)8-5-3-4-6-8/h8-9H,2-6H2,1H3
InChIKey: UKDOGUMRMRNHQA-UHFFFAOYSA-N
Canonical SMILES : CCOC(=O)C(C#N)C1CCCC1
 
Thermal Properties Value Condition Note
Boiling Point 135-138 °C Press: 17 Torr (1)CAS
Boiling Point 129 °C Press: 13 Torr (2)CAS
Boiling Point 92 °C Press: 0.900 Torr (3)IC

Specification

98%

References
  1. (1) Archer, Sydney; GB 632094 1949 CAPLUS
  2. (2) Vogel, Israel; Journal of the Chemical Society 1928, P2010-32 CAPLUS
  3. (3) Hajek, Milan; Collection of Czechoslovak Chemical Communications 1980, V45(7), P1940-9 CAPLUS
  4. (4) Ramachary, Dhevalapally B.; European Journal of Organic Chemistry 2008, (6), P975-993 CAPLUS
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