1H-1,2,3-Triazole-4-carboxylic acid, 1-[4-chloro-3-(trifluoromethyl)phenyl]-5-methyl-

CAS Registry Number®

1097050-88-8
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CAS Name

1H-1,2,3-Triazole-4-carboxylic acid, 1-[4-chloro-3-(trifluoromethyl)phenyl]-5-methyl-

Molecular Formula

C11H7ClF3N3O2

Molecular Mass

305.64

Cite this Page

1H-1,2,3-Triazole-4-carboxylic acid, 1-[4-chloro-3-(trifluoromethyl)phenyl]-5-methyl-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1097050-88-8 (retrieved 2024-09-01) (CAS RN: 1097050-88-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C11H7ClF3N3O2/c1-5-9(10(19)20)16-17-18(5)6-2-3-8(12)7(4-6)11(13,14)15/h2-4H,1H3,(H,19,20)

InChIKey

InChIKey=YVXJQVCNYKTYRY-UHFFFAOYSA-N

SMILES

CC=1N(N=NC1C(O)=O)C2=CC(C(F)(F)F)=C(Cl)C=C2

Canonical SMILES

O=C(O)C=1N=NN(C2=CC=C(Cl)C(=C2)C(F)(F)F)C1C

Other Names for this Substance

  • 1H-1,2,3-Triazole-4-carboxylic acid, 1-[4-chloro-3-(trifluoromethyl)phenyl]-5-methyl-
  • 1-[4-Chloro-3-(trifluoromethyl)phenyl]-5-methyl-1H-1,2,3-triazole-4-carboxylic acid
  • 1-(4-Chloro-3-trifluoromethyl-phenyl)-5-methyl-1H-[1,2,3]triazole-4-carboxylic acid