3-Ethynylbenzoic acid

CAS Registry Number®

10601-99-7

CAS Name

3-Ethynylbenzoic acid

Molecular Formula

C9H6O2

Molecular Mass

146.14

Cite this Page

3-Ethynylbenzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=10601-99-7 (retrieved 2024-11-23) (CAS RN: 10601-99-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H6O2/c1-2-7-4-3-5-8(6-7)9(10)11/h1,3-6H,(H,10,11)

InChIKey

InChIKey=PHPIMLZTBYCDSX-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(O)C=1C=CC=C(C#C)C1

Other Names for this Substance

  • Benzoic acid, 3-ethynyl-
  • Benzoic acid, m-ethynyl-
  • 3-Ethynylbenzoic acid
  • m-Ethynylbenzoic acid
  • 3-Carboxyphenylacetylene

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