Benzothiazolium, 5-chloro-3-ethyl-2-methyl-, 4-methylbenzenesulfonate (1:1)

CAS Registry Number®

63149-16-6
No image available.

CAS Name

Benzothiazolium, 5-chloro-3-ethyl-2-methyl-, 4-methylbenzenesulfonate (1:1)

Molecular Formula

C10H11ClNS.C7H7O3S

Cite this Page

Benzothiazolium, 5-chloro-3-ethyl-2-methyl-, 4-methylbenzenesulfonate (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=63149-16-6 (retrieved 2024-06-26) (CAS RN: 63149-16-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C10H11ClNS.C7H8O3S/c1-3-12-7(2)13-10-5-4-8(11)6-9(10)12;1-6-2-4-7(5-3-6)11(8,9)10/h4-6H,3H2,1-2H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1

InChIKey

InChIKey=GYXTWUJZURSNCF-UHFFFAOYSA-M

SMILES

C(C)[N+]=1C=2C(SC1C)=CC=C(Cl)C2.S(=O)(=O)([O-])C1=CC=C(C)C=C1

Canonical SMILES

O=S(=O)([O-])C1=CC=C(C=C1)C.ClC=1C=CC=2SC(=[N+](C2C1)CC)C

Other Names for this Substance

  • Benzothiazolium, 5-chloro-3-ethyl-2-methyl-, 4-methylbenzenesulfonate (1:1)
  • Benzothiazolium, 5-chloro-3-ethyl-2-methyl-, salt with 4-methylbenzenesulfonic acid (1:1)
  • 5-Chloro-3-ethyl-2-methylbenzothiazolium p-toluenesulfonate