4-Cyano-3-methylbenzenesulfonyl chloride

CAS Registry Number®

942199-57-7
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CAS Name

4-Cyano-3-methylbenzenesulfonyl chloride

Molecular Formula

C8H6ClNO2S

Molecular Mass

215.66

Cite this Page

4-Cyano-3-methylbenzenesulfonyl chloride.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=942199-57-7 (retrieved 2024-08-13) (CAS RN: 942199-57-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    52.5-53.0 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H6ClNO2S/c1-6-4-8(13(9,11)12)3-2-7(6)5-10/h2-4H,1H3

InChIKey

InChIKey=JGIAWVZWYDFMBJ-UHFFFAOYSA-N

SMILES

S(Cl)(=O)(=O)C1=CC(C)=C(C#N)C=C1

Canonical SMILES

N#CC1=CC=C(C=C1C)S(=O)(=O)Cl

Other Names for this Substance

  • Benzenesulfonyl chloride, 4-cyano-3-methyl-
  • 4-Cyano-3-methylbenzenesulfonyl chloride
  • 4-Cyano-3-methylbenzene-1-sulfonyl chloride