2-Chloro-4-sulfobenzoic acid

CAS Registry Number®

51084-27-6

CAS Name

2-Chloro-4-sulfobenzoic acid

Molecular Formula

C7H5ClO5S

Molecular Mass

236.63

Cite this Page

2-Chloro-4-sulfobenzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=51084-27-6 (retrieved 2024-11-25) (CAS RN: 51084-27-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C7H5ClO5S/c8-6-3-4(14(11,12)13)1-2-5(6)7(9)10/h1-3H,(H,9,10)(H,11,12,13)

InChIKey

InChIKey=ZTRKCBFXSUUQGS-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(O)C1=CC=C(C=C1Cl)S(=O)(=O)O

Other Names for this Substance

  • Benzoic acid, 2-chloro-4-sulfo-
  • 2-Chloro-4-sulfobenzoic acid
  • 4-Sulfo-2-chlorobenzoic acid

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