1-Phenyl-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid

CAS Registry Number®

98534-81-7
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CAS Name

1-Phenyl-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid

Molecular Formula

C11H7F3N2O2

Molecular Mass

256.18

Cite this Page

1-Phenyl-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=98534-81-7 (retrieved 2024-06-23) (CAS RN: 98534-81-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    132-134 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C11H7F3N2O2/c12-11(13,14)9-8(10(17)18)6-15-16(9)7-4-2-1-3-5-7/h1-6H,(H,17,18)

InChIKey

InChIKey=SMPJBTIFNUUWGQ-UHFFFAOYSA-N

SMILES

C(F)(F)(F)C=1N(N=CC1C(O)=O)C2=CC=CC=C2

Canonical SMILES

O=C(O)C=1C=NN(C=2C=CC=CC2)C1C(F)(F)F

Other Names for this Substance

  • 1H-Pyrazole-4-carboxylic acid, 1-phenyl-5-(trifluoromethyl)-
  • 1-Phenyl-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid
  • 1-Phenyl-5-trifluoromethyl-1H-pyrazole-4-carboxylic acid
  • 1-Phenyl-5-trifluoromethylpyrazole-4-carboxylic acid

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