2-Chloro-5-(cyanomethyl)benzoic acid

CAS Registry Number®

66658-58-0
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CAS Name

2-Chloro-5-(cyanomethyl)benzoic acid

Molecular Formula

C9H6ClNO2

Molecular Mass

195.60

Cite this Page

2-Chloro-5-(cyanomethyl)benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=66658-58-0 (retrieved 2024-09-07) (CAS RN: 66658-58-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H6ClNO2/c10-8-2-1-6(3-4-11)5-7(8)9(12)13/h1-2,5H,3H2,(H,12,13)

InChIKey

InChIKey=LZFDWEZPOAIFCG-UHFFFAOYSA-N

SMILES

C(O)(=O)C1=CC(CC#N)=CC=C1Cl

Canonical SMILES

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

Other Names for this Substance

  • Benzoic acid, 2-chloro-5-(cyanomethyl)-
  • 2-Chloro-5-(cyanomethyl)benzoic acid