5-Fluoro-4-nitro-2-(trifluoromethyl)benzoic acid

CAS Registry Number®

1140039-72-0
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CAS Name

5-Fluoro-4-nitro-2-(trifluoromethyl)benzoic acid

Molecular Formula

C8H3F4NO4

Molecular Mass

253.11

Cite this Page

5-Fluoro-4-nitro-2-(trifluoromethyl)benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1140039-72-0 (retrieved 2024-08-12) (CAS RN: 1140039-72-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C8H3F4NO4/c9-5-1-3(7(14)15)4(8(10,11)12)2-6(5)13(16)17/h1-2H,(H,14,15)

InChIKey

InChIKey=NIJGCNDZTDZZTL-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzoic acid, 5-fluoro-4-nitro-2-(trifluoromethyl)-
  • 5-Fluoro-4-nitro-2-(trifluoromethyl)benzoic acid