Phenyl 2-nitrobenzenesulfonate

CAS Registry Number®

41480-05-1

CAS Name

Phenyl 2-nitrobenzenesulfonate

Molecular Formula

C12H9NO5S

Molecular Mass

279.27

Cite this Page

Phenyl 2-nitrobenzenesulfonate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=41480-05-1 (retrieved 2024-10-16) (CAS RN: 41480-05-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    47-48 °C

Source(s)

Other Names and Identifiers

InChI

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

InChIKey

InChIKey=PAWIDEIFQKJVBG-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=N(=O)C=1C=CC=CC1S(=O)(=O)OC=2C=CC=CC2

Other Names for this Substance

  • Benzenesulfonic acid, 2-nitro-, phenyl ester
  • Benzenesulfonic acid, o-nitro-, phenyl ester
  • Phenyl 2-nitrobenzenesulfonate
  • NSC 146137
  • NSC 642585

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