2-Amino-3-nitro-5-(trifluoromethyl)benzoic acid

CAS Registry Number®

22227-60-7
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CAS Name

2-Amino-3-nitro-5-(trifluoromethyl)benzoic acid

Molecular Formula

C8H5F3N2O4

Molecular Mass

250.13

Cite this Page

2-Amino-3-nitro-5-(trifluoromethyl)benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=22227-60-7 (retrieved 2024-07-08) (CAS RN: 22227-60-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C8H5F3N2O4/c9-8(10,11)3-1-4(7(14)15)6(12)5(2-3)13(16)17/h1-2H,12H2,(H,14,15)

InChIKey

InChIKey=GGLXUJWJTSSOIL-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(O)C=1C=C(C=C(C1N)N(=O)=O)C(F)(F)F

Other Names for this Substance

  • Benzoic acid, 2-amino-3-nitro-5-(trifluoromethyl)-
  • m-Toluic acid, 6-amino-α,α,α-trifluoro-5-nitro-
  • 2-Amino-3-nitro-5-(trifluoromethyl)benzoic acid