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Substance Name: Guanidine, 1-(2-bromo-4,5-(methylenedioxy)phenethyl)-, hydrobromide
RN: 17228-47-6
InChIKey: KOHSFELBVDYUTE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H12-Br-N3-O2.Br-H

Molecular Weight

  • 322.589
 
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Names and Synonyms

Synonyms

  • 1-(2-(6-Bromo-1,3-dioxol-5-yl)ethyl)guanidine hydrobromide
  • 1-(2-Bromo-4,5-(methylenedioxy)phenethyl)guanidine hydrobromide

Systematic Name

  • Guanidine, 1-(2-bromo-4,5-(methylenedioxy)phenethyl)-, hydrobromide

Registry Numbers

CAS Registry Number

  • 17228-47-6

System Generated Number

  • 0017228476

Molecular Formulas

Molecular Formula

  • C10-H12-Br-N3-O2.Br-H

Molecular Formula Fragments

  • Br-H
  • C10-H12-Br-N3-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C10H12BrN3O2.ClH/c11-7-4-9-8(15-5-16-9)3-6(7)1-2-14-10(12)13;/h3-4H,1-2,5H2,(H4,12,13,14);1H

InChIKey

KOHSFELBVDYUTE-UHFFFAOYSA-N

Smiles

c12c(cc(Br)c(c1)CCNC(=N)[NH2+])OCO2.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 10mg/kg (10mg/kg)   Therapie. Vol. 23, Pg. 1221, 1968.