Benzenesulfonic acid, 4-methyl-, 4-nitrophenyl ester

CAS Registry Number®

1153-45-3

CAS Name

Benzenesulfonic acid, 4-methyl-, 4-nitrophenyl ester

Molecular Formula

C13H11NO5S

Molecular Mass

293.30

Cite this Page

Benzenesulfonic acid, 4-methyl-, 4-nitrophenyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1153-45-3 (retrieved 2024-11-26) (CAS RN: 1153-45-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H11NO5S/c1-10-2-8-13(9-3-10)20(17,18)19-12-6-4-11(5-7-12)14(15)16/h2-9H,1H3

InChIKey

InChIKey=DOXAGUPGJPEQFP-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=N(=O)C1=CC=C(OS(=O)(=O)C2=CC=C(C=C2)C)C=C1

Other Names for this Substance

  • Benzenesulfonic acid, 4-methyl-, 4-nitrophenyl ester
  • p-Toluenesulfonic acid, p-nitrophenyl ester
  • Phenol, p-nitro-, p-toluenesulfonate
  • p-Nitrophenyl p-toluenesulfonate
  • p-Nitrophenyl tosylate

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