2-Cyanobenzeneacetic acid

CAS Registry Number®

18698-99-2

CAS Name

2-Cyanobenzeneacetic acid

Molecular Formula

C9H7NO2

Molecular Mass

161.16

Cite this Page

2-Cyanobenzeneacetic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=18698-99-2 (retrieved 2024-11-28) (CAS RN: 18698-99-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    122-123 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H7NO2/c10-6-8-4-2-1-3-7(8)5-9(11)12/h1-4H,5H2,(H,11,12)

InChIKey

InChIKey=QLHZKPQKYARBGT-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

N#CC=1C=CC=CC1CC(=O)O

Other Names for this Substance

  • Benzeneacetic acid, 2-cyano-
  • Acetic acid, (o-cyanophenyl)-
  • 2-Cyanobenzeneacetic acid
  • 2-Cyanophenylacetic acid
  • 2-(2-Cyanophenyl)acetic acid

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