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Substance Name: 7H-Imidazo(2,1-b)thiazol-4-ium, 5,6-dihydro-3-(p-nitrophenyl)-, bromide
RN: 7496-63-1
InChIKey: UXNNSWCGPRLSJP-UHFFFAOYSA-N

Molecular Formula

  • C11-H10-N3-O2-S.Br

Molecular Weight

  • 328.189
 
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Names and Synonyms

Synonyms

  • 3-(p-Nitrophenyl)-5,6-dihydroimidazo(2,1-b)thiazoliumbromide
  • 5,6-Dihydro-3-(p-nitrophenyl)-7H-imidazo(2,1-b)thiazolium bromide

Systematic Name

  • 7H-Imidazo(2,1-b)thiazol-4-ium, 5,6-dihydro-3-(p-nitrophenyl)-, bromide

Registry Numbers

CAS Registry Number

  • 7496-63-1

System Generated Number

  • 0007496631

Molecular Formulas

Molecular Formula

  • C11-H10-N3-O2-S.Br

Molecular Formula Fragments

  • Br
  • C11-H10-N3-O2-S
  • COMPONENT

Structure Descriptors

InChI

1S/C11H9N3O2S.BrH/c15-14(16)9-3-1-8(2-4-9)10-7-17-11-12-5-6-13(10)11;/h1-4,7H,5-6H2;1H

InChIKey

UXNNSWCGPRLSJP-UHFFFAOYSA-N

Smiles

Br.[O-][N+](=O)c1ccc(cc1)C2=CSC3=NCCN23

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 56mg/kg (56mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#01180,