Cyclohexyl 2-cyanoacetate

CAS Registry Number®

52688-11-6

CAS Name

Cyclohexyl 2-cyanoacetate

Molecular Formula

C9H13NO2

Molecular Mass

167.21

Cite this Page

Cyclohexyl 2-cyanoacetate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=52688-11-6 (retrieved 2024-11-24) (CAS RN: 52688-11-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    103-108 °C @ Press: 0.5 Torr

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H13NO2/c10-7-6-9(11)12-8-4-2-1-3-5-8/h8H,1-6H2

InChIKey

InChIKey=YESQLMJPTKPRSK-UHFFFAOYSA-N

SMILES

O(C(CC#N)=O)C1CCCCC1

Canonical SMILES

N#CCC(=O)OC1CCCCC1

Other Names for this Substance

  • Acetic acid, 2-cyano-, cyclohexyl ester
  • Acetic acid, cyano-, cyclohexyl ester
  • Cyclohexyl 2-cyanoacetate
  • Cyclohexyl cyanoacetate
  • NSC 69952

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