3-[[3-(Trifluoromethyl)-1H-pyrazol-1-yl]methyl]benzoic acid

CAS Registry Number®

1004643-62-2

CAS Name

3-[[3-(Trifluoromethyl)-1H-pyrazol-1-yl]methyl]benzoic acid

Molecular Formula

C12H9F3N2O2

Molecular Mass

270.21

Cite this Page

3-[[3-(Trifluoromethyl)-1H-pyrazol-1-yl]methyl]benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1004643-62-2 (retrieved 2025-01-01) (CAS RN: 1004643-62-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H9F3N2O2/c13-12(14,15)10-4-5-17(16-10)7-8-2-1-3-9(6-8)11(18)19/h1-6H,7H2,(H,18,19)

InChIKey

InChIKey=IYMPJPDKJCWPQM-UHFFFAOYSA-N

SMILES

C(N1N=C(C(F)(F)F)C=C1)C2=CC(C(O)=O)=CC=C2

Canonical SMILES

O=C(O)C1=CC=CC(=C1)CN2N=C(C=C2)C(F)(F)F

Other Names for this Substance

  • Benzoic acid, 3-[[3-(trifluoromethyl)-1H-pyrazol-1-yl]methyl]-
  • 3-[[3-(Trifluoromethyl)-1H-pyrazol-1-yl]methyl]benzoic acid

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