Pentyl 4-methylbenzenesulfonate

CAS Registry Number®

4450-76-4
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CAS Name

Pentyl 4-methylbenzenesulfonate

Molecular Formula

C12H18O3S

Molecular Mass

242.33

Cite this Page

Pentyl 4-methylbenzenesulfonate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=4450-76-4 (retrieved 2024-08-17) (CAS RN: 4450-76-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H18O3S/c1-3-4-5-10-15-16(13,14)12-8-6-11(2)7-9-12/h6-9H,3-5,10H2,1-2H3

InChIKey

InChIKey=KOUCTZDKTJGHSS-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzenesulfonic acid, 4-methyl-, pentyl ester
  • p-Toluenesulfonic acid, pentyl ester
  • Pentyl 4-methylbenzenesulfonate
  • Pentyl p-toluenesulfonate
  • Pentyl tosylate