3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid

CAS Registry Number®

176969-34-9

CAS Name

3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid

Molecular Formula

C6H6F2N2O2

Molecular Mass

176.12

Cite this Page

3-(Difluoromethyl)-1-methyl-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=176969-34-9 (retrieved 2024-11-21) (CAS RN: 176969-34-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    200-201 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)

InChIKey

InChIKey=RLOHOBNEYHBZID-UHFFFAOYSA-N

SMILES

C(O)(=O)C=1C(C(F)F)=NN(C)C1

Canonical SMILES

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

Other Names for this Substance

  • 1H-Pyrazole-4-carboxylic acid, 3-(difluoromethyl)-1-methyl-
  • 3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid
  • 3-Difluoromethyl-1-methyl-1H-pyrazole-4-carboxylic acid
  • 3-Difluoromethyl-1-methylpyrazole-4-carboxylic acid
  • 3-Difluoromethyl-1-methyl-1H-pyrazol-4-carboxylic acid

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