4-Chlorophenyl benzenesulfonate

80-38-6

CAS Name

4-Chlorophenyl benzenesulfonate

Molecular Formula

C₁₂H₉ClO₃S

Molecular Mass

268.72

Compound Properties

• Melting Point (1)

  62 °C

• Density (1)

  1.33 g/cm³

Source(s)

• (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)

Other Names and Identifiers

InChI

InChI=1S/C12H9ClO3S/c13-10-6-8-11(9-7-10)16-17(14,15)12-4-2-1-3-5-12/h1-9H

InChIKey

InChIKey=SPJOZZSIXXJYBT-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=S(=O)(OC1=CC=C(Cl)C=C1)C=2C=CC=CC2

Other Names for this Substance