2-Chloro-4-fluoro-3-methyl-5-nitrobenzoic acid

CAS Registry Number®

173315-56-5
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CAS Name

2-Chloro-4-fluoro-3-methyl-5-nitrobenzoic acid

Molecular Formula

C8H5ClFNO4

Molecular Mass

233.58

Cite this Page

2-Chloro-4-fluoro-3-methyl-5-nitrobenzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=173315-56-5 (retrieved 2024-07-02) (CAS RN: 173315-56-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C8H5ClFNO4/c1-3-6(9)4(8(12)13)2-5(7(3)10)11(14)15/h2H,1H3,(H,12,13)

InChIKey

InChIKey=VXVDKJNGNAJVGQ-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(O)C=1C=C(C(F)=C(C1Cl)C)N(=O)=O

Other Names for this Substance

  • Benzoic acid, 2-chloro-4-fluoro-3-methyl-5-nitro-
  • 2-Chloro-4-fluoro-3-methyl-5-nitrobenzoic acid