5-Methyl-1-[3-(trifluoromethyl)phenyl]-1H-pyrazole-3-carboxylic acid

CAS Registry Number®

126067-60-5

CAS Name

5-Methyl-1-[3-(trifluoromethyl)phenyl]-1H-pyrazole-3-carboxylic acid

Molecular Formula

C12H9F3N2O2

Molecular Mass

270.21

Cite this Page

5-Methyl-1-[3-(trifluoromethyl)phenyl]-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=126067-60-5 (retrieved 2024-11-21) (CAS RN: 126067-60-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    190-191 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C12H9F3N2O2/c1-7-5-10(11(18)19)16-17(7)9-4-2-3-8(6-9)12(13,14)15/h2-6H,1H3,(H,18,19)

InChIKey

InChIKey=QMDOPJDETJJZEG-UHFFFAOYSA-N

SMILES

CC=1N(N=C(C(O)=O)C1)C2=CC(C(F)(F)F)=CC=C2

Canonical SMILES

O=C(O)C1=NN(C2=CC=CC(=C2)C(F)(F)F)C(=C1)C

Other Names for this Substance

  • 1H-Pyrazole-3-carboxylic acid, 5-methyl-1-[3-(trifluoromethyl)phenyl]-
  • 5-Methyl-1-[3-(trifluoromethyl)phenyl]-1H-pyrazole-3-carboxylic acid

CAS INSIGHTSTM
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