3-Chloro-2-methyl-6-nitrobenzenesulfonic acid

CAS Registry Number®

68368-39-8

CAS Name

3-Chloro-2-methyl-6-nitrobenzenesulfonic acid

Molecular Formula

C7H6ClNO5S

Molecular Mass

251.64

Cite this Page

3-Chloro-2-methyl-6-nitrobenzenesulfonic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=68368-39-8 (retrieved 2024-11-22) (CAS RN: 68368-39-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C7H6ClNO5S/c1-4-5(8)2-3-6(9(10)11)7(4)15(12,13)14/h2-3H,1H3,(H,12,13,14)

InChIKey

InChIKey=IRDVVOKGYRSNHH-UHFFFAOYSA-N

SMILES

S(=O)(=O)(O)C1=C(N(=O)=O)C=CC(Cl)=C1C

Canonical SMILES

O=N(=O)C1=CC=C(Cl)C(=C1S(=O)(=O)O)C

Other Names for this Substance

  • Benzenesulfonic acid, 3-chloro-2-methyl-6-nitro-
  • 3-Chloro-2-methyl-6-nitrobenzenesulfonic acid

CAS INSIGHTSTM
Hourglass and a clock