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Substance Name: 1,2-Benzenediol, 5-(2-amino-4-thiazolyl)-3-nitro-, monohydrobromide
RN: 125629-11-0
InChIKey: QDSGPDIHYXSHBN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C9-H7-N3-O4-S.Br-H

Molecular Weight

  • 334.1492
 
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Names and Synonyms

Synonyms

  • 5-(2-Amino-4-thiazolyl)-3-nitro-1,2-benzenediol monohydrobromide
  • RTECS CX2310000

Systematic Name

  • 1,2-Benzenediol, 5-(2-amino-4-thiazolyl)-3-nitro-, monohydrobromide

Registry Numbers

CAS Registry Number

  • 125629-11-0

System Generated Number

  • 0125629110

Molecular Formulas

Molecular Formula

  • C9-H7-N3-O4-S.Br-H

Molecular Formula Fragments

  • Br-H
  • C9-H7-N3-O4-S
  • COMPONENT

Structure Descriptors

InChI

1S/C9H7N3O4S.BrH/c10-9-11-5(3-17-9)4-1-6(12(15)16)8(14)7(13)2-4;/h1-3,13-14H,(H2,10,11);1H

InChIKey

QDSGPDIHYXSHBN-UHFFFAOYSA-N

Smiles

c1c(cc(c(c1[N+](=O)[O-])O)O)c2csc(n2)N.Br

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 5gm/kg (5000mg/kg)   Helvetica Chimica Acta. Vol. 72, Pg. 952, 1989.