3-Cyano-2-methylbenzoic acid

CAS Registry Number®

3843-99-0
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CAS Name

3-Cyano-2-methylbenzoic acid

Molecular Formula

C9H7NO2

Molecular Mass

161.16

Cite this Page

3-Cyano-2-methylbenzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=3843-99-0 (retrieved 2024-09-07) (CAS RN: 3843-99-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H7NO2/c1-6-7(5-10)3-2-4-8(6)9(11)12/h2-4H,1H3,(H,11,12)

InChIKey

InChIKey=QPEFUCOMFYTEKE-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

N#CC1=CC=CC(C(=O)O)=C1C

Other Names for this Substance

  • Benzoic acid, 3-cyano-2-methyl-
  • o-Toluic acid, 3-cyano-
  • 3-Cyano-2-methylbenzoic acid
  • 2-Methyl-3-cyanobenzoic acid