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Substance Name: 3(2H)-Isothiazolone, 5-chloro-2-methyl-, hydrochloride (1:1)
RN: 26530-03-0
InChIKey: RGVYUPIYFIVQDS-UHFFFAOYSA-N

Molecular Formula

  • C4-H4-Cl-N-O-S.Cl-H

Molecular Weight

  • 186.0615
 
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Names and Synonyms

Synonyms

  • 5-Chloro-2-methyl-4-isothiazolin-3-one hydrochloride
  • EINECS 247-760-1

Systematic Names

  • 3(2H)-Isothiazolone, 5-chloro-2-methyl-, hydrochloride
  • 3(2H)-Isothiazolone, 5-chloro-2-methyl-, hydrochloride (1:1)
  • 5-Chloro-2-methyl-2H-isothiazol-3-one hydrochloride

Registry Numbers

CAS Registry Number

  • 26530-03-0

Other Registry Number

  • 116680-96-7

Related Registry Number

  • 26172-55-4 (Parent)

System Generated Number

  • 0026530030

Molecular Formulas

Molecular Formula

  • C4-H4-Cl-N-O-S.Cl-H

Molecular Formula Fragments

  • C4-H4-Cl-N-O-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C4H4ClNOS.ClH/c1-6-4(7)2-3(5)8-6;/h2H,1H3;1H

InChIKey

RGVYUPIYFIVQDS-UHFFFAOYSA-N

Smiles

Cl.CN1SC(=CC1=O)Cl