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Substance Name: Valeronitrile, 4,4-dimethyl-5-((beta-hydroxy-alpha-methylphenethyl)amino)-, hydrochloride
RN: 18855-07-7
InChIKey: DQVUFJBOIHSKOK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H24-N2-O.Cl-H

Molecular Weight

  • 296.84
 
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Names and Synonyms

Synonyms

  • 4,4-Dimethyl-5-((beta-hydroxy-alpha-methylphenethyl)amino)valeronitrile hydrochloride
  • BS-38

Systematic Name

  • Valeronitrile, 4,4-dimethyl-5-((beta-hydroxy-alpha-methylphenethyl)amino)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 18855-07-7

System Generated Number

  • 0018855077

Molecular Formulas

Molecular Formula

  • C16-H24-N2-O.Cl-H

Molecular Formula Fragments

  • C16-H24-N2-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C16H24N2O.ClH/c1-13(15(19)14-8-5-4-6-9-14)18-12-16(2,3)10-7-11-17;/h4-6,8-9,13,15,18-19H,7,10,12H2,1-3H3;1H

InChIKey

DQVUFJBOIHSKOK-UHFFFAOYSA-N

Smiles

C(CCC(CN[C@@H]([C@@H](c1ccccc1)O)C)(C)C)#N.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 154mg/kg (154mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD Acta Biologica et Medica Germanica. Vol. 19, Pg. 463, 1967.