Isopropyl benzenesulfonate

CAS Registry Number®

6214-18-2

CAS Name

Isopropyl benzenesulfonate

Molecular Formula

C9H12O3S

Molecular Mass

200.25

Cite this Page

Isopropyl benzenesulfonate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=6214-18-2 (retrieved 2024-11-23) (CAS RN: 6214-18-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    155 °C @ Press: 7 Torr

  • Density (1)

    1.145 g/cm³ @ Temp: 20 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H12O3S/c1-8(2)12-13(10,11)9-6-4-3-5-7-9/h3-8H,1-2H3

InChIKey

InChIKey=YQZZXXKFKTWDPY-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=S(=O)(OC(C)C)C=1C=CC=CC1

Other Names for this Substance

  • Benzenesulfonic acid, 1-methylethyl ester
  • Benzenesulfonic acid, isopropyl ester
  • Isopropyl benzenesulfonate
  • 1-Methylethyl benzenesulfonate

CAS INSIGHTSTM
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