2-Pentenoic acid, 2-cyano-3-methyl-, ethyl ester

CAS Registry Number®

759-51-3

CAS Name

2-Pentenoic acid, 2-cyano-3-methyl-, ethyl ester

Molecular Formula

C9H13NO2

Molecular Mass

167.21

Cite this Page

2-Pentenoic acid, 2-cyano-3-methyl-, ethyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=759-51-3 (retrieved 2024-11-20) (CAS RN: 759-51-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    116-118 °C @ Press: 11 Torr

  • Melting Point (2)

    27 °C

  • Density (1)

    1.0001 g/cm³ @ Temp: 25 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H13NO2/c1-4-7(3)8(6-10)9(11)12-5-2/h4-5H2,1-3H3

InChIKey

InChIKey=WBPLDHMXQALQAT-UHFFFAOYSA-N

SMILES

C(C(OCC)=O)(=C(CC)C)C#N

Canonical SMILES

N#CC(C(=O)OCC)=C(C)CC

Other Names for this Substance

  • 2-Pentenoic acid, 2-cyano-3-methyl-, ethyl ester
  • Ethyl 2-cyano-3-methyl-2-pentenoate
  • NSC 67978
  • 2-Cyano-3-methylpent-2-enoic acid ethyl ester

CAS INSIGHTSTM
Targeted protein degrader structure, illustration