Methyl 4-amino-3-cyanobenzoate

CAS Registry Number®

159847-80-0
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CAS Name

Methyl 4-amino-3-cyanobenzoate

Molecular Formula

C9H8N2O2

Molecular Mass

176.17

Cite this Page

Methyl 4-amino-3-cyanobenzoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=159847-80-0 (retrieved 2024-09-08) (CAS RN: 159847-80-0).  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)6-2-3-8(11)7(4-6)5-10/h2-4H,11H2,1H3

InChIKey

InChIKey=QSPXZVQTLYMWEU-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

N#CC1=CC(=CC=C1N)C(=O)OC

Other Names for this Substance

  • Benzoic acid, 4-amino-3-cyano-, methyl ester
  • Methyl 4-amino-3-cyanobenzoate
  • 4-Amino-3-cyanobenzoic acid methyl ester