4-(1H-Pyrazol-4-yl)benzoic acid

CAS Registry Number®

1017794-47-6

CAS Name

4-(1H-Pyrazol-4-yl)benzoic acid

Molecular Formula

C10H8N2O2

Molecular Mass

188.18

Cite this Page

4-(1H-Pyrazol-4-yl)benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1017794-47-6 (retrieved 2024-10-05) (CAS RN: 1017794-47-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C10H8N2O2/c13-10(14)8-3-1-7(2-4-8)9-5-11-12-6-9/h1-6H,(H,11,12)(H,13,14)

InChIKey

InChIKey=ZGICHEMKLPXWPZ-UHFFFAOYSA-N

SMILES

C(O)(=O)C1=CC=C(C=C1)C=2C=NNC2

Canonical SMILES

O=C(O)C=1C=CC(=CC1)C=2C=NNC2

Other Names for this Substance

  • Benzoic acid, 4-(1H-pyrazol-4-yl)-
  • 4-(1H-Pyrazol-4-yl)benzoic acid

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