1-(3-Cyanophenyl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxylic acid

CAS Registry Number®

209917-93-1
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CAS Name

1-(3-Cyanophenyl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxylic acid

Molecular Formula

C12H6F3N3O2

Molecular Mass

281.19

Cite this Page

1-(3-Cyanophenyl)-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=209917-93-1 (retrieved 2024-07-02) (CAS RN: 209917-93-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H6F3N3O2/c13-12(14,15)10-5-9(11(19)20)18(17-10)8-3-1-2-7(4-8)6-16/h1-5H,(H,19,20)

InChIKey

InChIKey=FQVUSLUPETYVCP-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

N#CC1=CC=CC(=C1)N2N=C(C=C2C(=O)O)C(F)(F)F

Other Names for this Substance

  • 1H-Pyrazole-5-carboxylic acid, 1-(3-cyanophenyl)-3-(trifluoromethyl)-
  • 1-(3-Cyanophenyl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxylic acid
  • 1-(3-Cyanophenyl)-3-trifluoromethylpyrazole-5-carboxylic acid
  • 2-(3-Cyanophenyl)-5-trifluoromethyl-2H-pyrazole-3-carboxylic acid