1H-Pyrazole-4-carboxylic acid, 3-methyl-1-(2,2,2-trifluoroethyl)-

CAS Registry Number®

113100-55-3

CAS Name

1H-Pyrazole-4-carboxylic acid, 3-methyl-1-(2,2,2-trifluoroethyl)-

Molecular Formula

C7H7F3N2O2

Molecular Mass

208.14

Cite this Page

1H-Pyrazole-4-carboxylic acid, 3-methyl-1-(2,2,2-trifluoroethyl)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=113100-55-3 (retrieved 2024-11-29) (CAS RN: 113100-55-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C7H7F3N2O2/c1-4-5(6(13)14)2-12(11-4)3-7(8,9)10/h2H,3H2,1H3,(H,13,14)

InChIKey

InChIKey=CHTJYARIOYPNAG-UHFFFAOYSA-N

SMILES

C(O)(=O)C1=CN(CC(F)(F)F)N=C1C

Canonical SMILES

O=C(O)C1=CN(N=C1C)CC(F)(F)F

Other Names for this Substance

  • 1H-Pyrazole-4-carboxylic acid, 3-methyl-1-(2,2,2-trifluoroethyl)-
  • 3-Methyl-1-(2,2,2-trifluoroethyl)-1H-pyrazole-4-carboxylic acid
  • 3-Methyl-1-(2,2,2-trifluoroethyl)pyrazole-4-carboxylic acid

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