Benzoic acid, 2-amino-4-cyano-, methyl ester

CAS Registry Number®

159847-83-3
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CAS Name

Benzoic acid, 2-amino-4-cyano-, methyl ester

Molecular Formula

C9H8N2O2

Molecular Mass

176.17

Cite this Page

Benzoic acid, 2-amino-4-cyano-, methyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=159847-83-3 (retrieved 2024-09-09) (CAS RN: 159847-83-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H8N2O2/c1-13-9(12)7-3-2-6(5-10)4-8(7)11/h2-4H,11H2,1H3

InChIKey

InChIKey=VCYAYJCEAKQYAM-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

N#CC1=CC=C(C(=O)OC)C(N)=C1

Other Names for this Substance

  • Benzoic acid, 2-amino-4-cyano-, methyl ester
  • 2-Amino-4-cyanobenzoic acid methyl ester
  • Methyl 2-amino-4-cyanobenzoate