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Substance Name: Imidazole, 4,5-dimethyl-, 1,2-ethanedisulfonate (2:1)
RN: 29584-96-1
InChIKey: YDYWKOJMDIEFRT-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C5-H8-N2.1/2C2-H6-O6-S2

Molecular Weight

  • 382.46
 
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Names and Synonyms

Synonym

  • 4,5-Dimethylimidazole 1,2-ethanedisulfonate

Systematic Name

  • Imidazole, 4,5-dimethyl-, 1,2-ethanedisulfonate (2:1)

Registry Numbers

CAS Registry Number

  • 29584-96-1

System Generated Number

  • 0029584961

Molecular Formulas

Molecular Formula

  • C5-H8-N2.1/2C2-H6-O6-S2

Molecular Formula Fragments

  • C2-H6-O6-S2
  • C5-H8-N2
  • COMPONENT

Structure Descriptors

InChI

1S/2C5H8N2.C2H6O6S2/c2*1-4-5(2)7-3-6-4;3-9(4,5)1-2-10(6,7)8/h2*3H,1-2H3,(H,6,7);1-2H2,(H,3,4,5)(H,6,7,8)

InChIKey

YDYWKOJMDIEFRT-UHFFFAOYSA-N

Smiles

C(CS(=O)(=O)O)S(=O)(=O)O.[nH]1cnc(c1C)C.[nH]1cnc(c1C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 165mg/kg (165mg/kg)   Acta Pharmaceutica Suecica. Vol. 7, Pg. 423, 1970.