Ethyl 2-cyano-3-methylhexanoate

CAS Registry Number®

19823-28-0
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CAS Name

Ethyl 2-cyano-3-methylhexanoate

Molecular Formula

C10H17NO2

Molecular Mass

183.25

Cite this Page

Ethyl 2-cyano-3-methylhexanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=19823-28-0 (retrieved 2024-07-05) (CAS RN: 19823-28-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    101.5 °C @ Press: 4 Torr

  • Density (1)

    0.8991 g/cm³ @ Temp: 86.5 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C10H17NO2/c1-4-6-8(3)9(7-11)10(12)13-5-2/h8-9H,4-6H2,1-3H3

InChIKey

InChIKey=FIJVOSSCAUGKQY-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Hexanoic acid, 2-cyano-3-methyl-, ethyl ester
  • Ethyl 2-cyano-3-methylhexanoate
  • NSC 46918
  • 2-Cyano-3-methyl-hexanoic acid ethyl ester