5-[(4-Chlorophenyl)methyl]-1H-pyrazole-3-carboxylic acid

CAS Registry Number®

595610-52-9

CAS Name

5-[(4-Chlorophenyl)methyl]-1H-pyrazole-3-carboxylic acid

Molecular Formula

C11H9ClN2O2

Molecular Mass

236.65

Cite this Page

5-[(4-Chlorophenyl)methyl]-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=595610-52-9 (retrieved 2024-11-23) (CAS RN: 595610-52-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    224-225 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C11H9ClN2O2/c12-8-3-1-7(2-4-8)5-9-6-10(11(15)16)14-13-9/h1-4,6H,5H2,(H,13,14)(H,15,16)

InChIKey

InChIKey=YKKXGQMJMUSFFP-UHFFFAOYSA-N

SMILES

C(C1=CC(C(O)=O)=NN1)C2=CC=C(Cl)C=C2

Canonical SMILES

O=C(O)C1=NNC(=C1)CC2=CC=C(Cl)C=C2

Other Names for this Substance

  • 1H-Pyrazole-3-carboxylic acid, 5-[(4-chlorophenyl)methyl]-
  • 5-[(4-Chlorophenyl)methyl]-1H-pyrazole-3-carboxylic acid
  • 3-[(4-Chlorophenyl)methyl]-1H-pyrazole-5-carboxylic acid

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