3-[2-(3-Aminophenyl)ethynyl]benzoic acid

CAS Registry Number®

930395-90-7
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CAS Name

3-[2-(3-Aminophenyl)ethynyl]benzoic acid

Molecular Formula

C15H11NO2

Molecular Mass

237.25

Cite this Page

3-[2-(3-Aminophenyl)ethynyl]benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=930395-90-7 (retrieved 2024-08-24) (CAS RN: 930395-90-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C15H11NO2/c16-14-6-2-4-12(10-14)8-7-11-3-1-5-13(9-11)15(17)18/h1-6,9-10H,16H2,(H,17,18)

InChIKey

InChIKey=FFVXLVGENPCMDI-UHFFFAOYSA-N

SMILES

C(#CC1=CC(N)=CC=C1)C2=CC(C(O)=O)=CC=C2

Canonical SMILES

O=C(O)C=1C=CC=C(C#CC2=CC=CC(N)=C2)C1

Other Names for this Substance

  • Benzoic acid, 3-[2-(3-aminophenyl)ethynyl]-
  • 3-[2-(3-Aminophenyl)ethynyl]benzoic acid