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Substance Name: Pyrimidinium, 1,4,5,6-tetrahydro-2-methylthio-, iodide
RN: 5445-73-8
InChIKey: RUXGXTKDBJMOAM-UHFFFAOYSA-N

Molecular Formula

  • C5-H11-N2-S.I

Molecular Weight

  • 258.122
 
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Names and Synonyms

Synonyms

  • 2-Methylmercapto-delta(sup 2)-tetrahydropyrimidinium iodide
  • NSC 22197
  • Pyrimidinium, 1,4,5,6-tetrahydro-2-methylthio-, iodide

Systematic Names

  • Pyrimidine, 1,4,5,6-tetrahydro-2-(methylthio)-, monohydriodide (8CI)(9CI)
  • Pyrimidinium, 1,4,5,6-tetrahydro-2-methylthio-, iodide

Registry Numbers

CAS Registry Number

  • 5445-73-8

System Generated Number

  • 0005445738

Molecular Formulas

Molecular Formula

  • C5-H11-N2-S.I

Molecular Formula Fragments

  • C5-H11-N2-S
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C5H10N2S.HI/c1-8-5-6-3-2-4-7-5;/h2-4H2,1H3,(H,6,7);1H

InChIKey

RUXGXTKDBJMOAM-UHFFFAOYSA-N

Smiles

C1(=NCCCN1)SC.I

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 178mg/kg (178mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#00726,