Phenyl 3-nitrobenzenesulfonate

CAS Registry Number®

41480-04-0
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CAS Name

Phenyl 3-nitrobenzenesulfonate

Molecular Formula

C12H9NO5S

Molecular Mass

279.27

Cite this Page

Phenyl 3-nitrobenzenesulfonate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=41480-04-0 (retrieved 2024-09-13) (CAS RN: 41480-04-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H9NO5S/c14-13(15)10-5-4-8-12(9-10)19(16,17)18-11-6-2-1-3-7-11/h1-9H

InChIKey

InChIKey=ISRIIYJVEICKKW-UHFFFAOYSA-N

SMILES

S(OC1=CC=CC=C1)(=O)(=O)C2=CC(N(=O)=O)=CC=C2

Canonical SMILES

O=N(=O)C1=CC=CC(=C1)S(=O)(=O)OC=2C=CC=CC2

Other Names for this Substance

  • Benzenesulfonic acid, 3-nitro-, phenyl ester
  • Benzenesulfonic acid, m-nitro-, phenyl ester
  • Phenyl 3-nitrobenzenesulfonate
  • NSC 23313
  • 3-Nitro-benzenesulfonic acid phenyl ester