4-Chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxylic acid

CAS Registry Number®

128694-71-3

CAS Name

4-Chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxylic acid

Molecular Formula

C6H4ClF3N2O2

Molecular Mass

228.56

Cite this Page

4-Chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=128694-71-3 (retrieved 2024-12-04) (CAS RN: 128694-71-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    180-182 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C6H4ClF3N2O2/c1-12-3(5(13)14)2(7)4(11-12)6(8,9)10/h1H3,(H,13,14)

InChIKey

InChIKey=JXWXOYNVUAWUIW-UHFFFAOYSA-N

SMILES

ClC=1C(C(F)(F)F)=NN(C)C1C(O)=O

Canonical SMILES

O=C(O)C1=C(Cl)C(=NN1C)C(F)(F)F

Other Names for this Substance

  • 1H-Pyrazole-5-carboxylic acid, 4-chloro-1-methyl-3-(trifluoromethyl)-
  • 4-Chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxylic acid

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