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Substance Name: Isoquinolinium, 2-ethyl-5-hydroxy-, bromide
RN: 4501-30-8
InChIKey: DGBDVEWOXFCLJE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H12-N-O.Br

Molecular Weight

  • 254.126
 
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Names and Synonyms

Synonym

  • 2-Ethyl-5-hydroxyisoquinolinium, bromide

Systematic Name

  • Isoquinolinium, 2-ethyl-5-hydroxy-, bromide

Registry Numbers

CAS Registry Number

  • 4501-30-8

System Generated Number

  • 0004501308

Molecular Formulas

Molecular Formula

  • C11-H12-N-O.Br

Molecular Formula Fragments

  • Br
  • C11-H12-N-O
  • COMPONENT

Structure Descriptors

InChI

1S/C11H11NO.BrH/c1-2-12-7-6-10-9(8-12)4-3-5-11(10)13;/h3-8H,2H2,1H3;1H

InChIKey

DGBDVEWOXFCLJE-UHFFFAOYSA-N

Smiles

c12c(cc[n+](c1)CC)c(ccc2)O.[BrH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 63mg/kg (63mg/kg)   Chimica Therapeutica. Vol. 3, Pg. 438, 1968.