2,3,4,5,6-Pentafluorophenyl 4-cyanobenzenesulfonate

CAS Registry Number®

885949-56-4
No image available.

CAS Name

2,3,4,5,6-Pentafluorophenyl 4-cyanobenzenesulfonate

Molecular Formula

C13H4F5NO3S

Molecular Mass

349.23

Cite this Page

2,3,4,5,6-Pentafluorophenyl 4-cyanobenzenesulfonate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=885949-56-4 (retrieved 2024-08-19) (CAS RN: 885949-56-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H4F5NO3S/c14-8-9(15)11(17)13(12(18)10(8)16)22-23(20,21)7-3-1-6(5-19)2-4-7/h1-4H

InChIKey

InChIKey=HKXQPGWUQBZUIK-UHFFFAOYSA-N

SMILES

O(S(=O)(=O)C1=CC=C(C#N)C=C1)C2=C(F)C(F)=C(F)C(F)=C2F

Canonical SMILES

N#CC1=CC=C(C=C1)S(=O)(=O)OC=2C(F)=C(F)C(F)=C(F)C2F

Other Names for this Substance

  • Benzenesulfonic acid, 4-cyano-, 2,3,4,5,6-pentafluorophenyl ester
  • Benzenesulfonic acid, 4-cyano-, pentafluorophenyl ester
  • 2,3,4,5,6-Pentafluorophenyl 4-cyanobenzenesulfonate