5-(4-Chlorophenyl)-1-(4-fluorophenyl)-1H-pyrazole-3-carboxylic acid

CAS Registry Number®

477712-02-0

CAS Name

5-(4-Chlorophenyl)-1-(4-fluorophenyl)-1H-pyrazole-3-carboxylic acid

Molecular Formula

C16H10ClFN2O2

Molecular Mass

316.71

Cite this Page

5-(4-Chlorophenyl)-1-(4-fluorophenyl)-1H-pyrazole-3-carboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=477712-02-0 (retrieved 2024-11-23) (CAS RN: 477712-02-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    172.2-173.1 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C16H10ClFN2O2/c17-11-3-1-10(2-4-11)15-9-14(16(21)22)19-20(15)13-7-5-12(18)6-8-13/h1-9H,(H,21,22)

InChIKey

InChIKey=WNSWJNDGYALZPM-UHFFFAOYSA-N

SMILES

C(O)(=O)C=1C=C(N(N1)C2=CC=C(F)C=C2)C3=CC=C(Cl)C=C3

Canonical SMILES

O=C(O)C1=NN(C2=CC=C(F)C=C2)C(=C1)C=3C=CC(Cl)=CC3

Other Names for this Substance

  • 1H-Pyrazole-3-carboxylic acid, 5-(4-chlorophenyl)-1-(4-fluorophenyl)-
  • 5-(4-Chlorophenyl)-1-(4-fluorophenyl)-1H-pyrazole-3-carboxylic acid
  • 1-(4-Fluorophenyl)-5-(4-chlorophenyl)-1H-pyrazole-3-carboxylic acid

CAS INSIGHTSTM
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