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Substance Name: Benzyl alcohol, alpha-(1-(isobutylamino)ethyl)-, hydrochloride
RN: 18855-04-4
InChIKey: SMHOFWWRACCYAD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H21-N-O.Cl-H

Molecular Weight

  • 243.776
 
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Names and Synonyms

Synonyms

  • alpha-(1-(Isobutylamino)ethyl)benzyl alcohol hydrochloride
  • BS-36

Systematic Name

  • Benzyl alcohol, alpha-(1-(isobutylamino)ethyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 18855-04-4

System Generated Number

  • 0018855044

Molecular Formulas

Molecular Formula

  • C13-H21-N-O.Cl-H

Molecular Formula Fragments

  • C13-H21-N-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C13H21NO.ClH/c1-10(2)9-14-11(3)13(15)12-7-5-4-6-8-12;/h4-8,10-11,13-15H,9H2,1-3H3;1H

InChIKey

SMHOFWWRACCYAD-UHFFFAOYSA-N

Smiles

c1([C@@H]([C@@H]([NH2+]CC(C)C)C)O)ccccc1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 92mg/kg (92mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD Acta Biologica et Medica Germanica. Vol. 19, Pg. 463, 1967.