Methyl 3,5-bis(cyanomethyl)benzoate

CAS Registry Number®

29232-73-3
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CAS Name

Methyl 3,5-bis(cyanomethyl)benzoate

Molecular Formula

C12H10N2O2

Molecular Mass

214.22

Cite this Page

Methyl 3,5-bis(cyanomethyl)benzoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=29232-73-3 (retrieved 2024-08-24) (CAS RN: 29232-73-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    91-93 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H10N2O2/c1-16-12(15)11-7-9(2-4-13)6-10(8-11)3-5-14/h6-8H,2-3H2,1H3

InChIKey

InChIKey=XCLVFUZGTQMXJV-UHFFFAOYSA-N

SMILES

C(OC)(=O)C1=CC(CC#N)=CC(CC#N)=C1

Canonical SMILES

N#CCC1=CC(=CC(=C1)CC#N)C(=O)OC

Other Names for this Substance

  • Benzoic acid, 3,5-bis(cyanomethyl)-, methyl ester
  • Methyl 3,5-bis(cyanomethyl)benzoate
  • 3,5-Bis(cyanomethyl)benzoic acid methyl ester