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Substance Name: 2-(alpha-Hydroxyethyl)-3,4-dimethylthiazolium
RN: 51169-57-4
InChIKey: RLTJVQZAYRRZOI-UHFFFAOYSA-M

Note

  • Model for 2-(alpha-hydroxyethyl)thiamine used in elucidating mechanism of thiamine catalysis.

Molecular Formula

  • C7-H12-N-O-S.Br

Molecular Weight

  • 238.1478
 
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Names and Synonyms

Name of Substance

  • 2-(alpha-Hydroxyethyl)-3,4-dimethylthiazolium

Synonyms

  • 2-(alpha-Hydroxyethyl)-3,4-dimethylthiazolium bromide
  • 2-HE-Dmt

Systematic Name

  • Thiazolium, 2-(1-hydroxyethyl)-3,4-dimethyl-, bromide

Registry Numbers

CAS Registry Number

  • 51169-57-4

System Generated Number

  • 0051169574

Molecular Formulas

Molecular Formula

  • C7-H12-N-O-S.Br

Molecular Formula Fragments

  • Br
  • C7-H12-N-O-S
  • COMPONENT

Structure Descriptors

InChI

1S/C7H12NOS.BrH/c1-5-4-10-7(6(2)9)8(5)3;/h4,6,9H,1-3H3;1H/q+1;/p-1

InChIKey

RLTJVQZAYRRZOI-UHFFFAOYSA-M

Smiles

Cc1csc([n+]1C)C(C)O.[Br-]