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Substance Name: 1H-3-Benzazepine, 2,3,4,5-tetrahydro-3-(2-propynyl)-, hydrochloride
RN: 20904-28-3
InChIKey: IRZCDHUIWBVEOV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H15-N.Cl-H

Molecular Weight

  • 221.729
 
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Names and Synonyms

Synonyms

  • 2,3,4,5-Tetrahydro-3-(2-propynyl)-1H-3-benzazepine hydrochloride
  • 3-Propargyl-2,3,4,5-tetrahydro-1H-3-benzazepine hydrochloride

Systematic Name

  • 1H-3-Benzazepine, 2,3,4,5-tetrahydro-3-(2-propynyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 20904-28-3

System Generated Number

  • 0020904283

Molecular Formulas

Molecular Formula

  • C13-H15-N.Cl-H

Molecular Formula Fragments

  • C13-H15-N
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C13H15N.ClH/c1-2-9-14-10-7-12-5-3-4-6-13(12)8-11-14;/h1,3-6H,7-11H2;1H

InChIKey

IRZCDHUIWBVEOV-UHFFFAOYSA-N

Smiles

N1(CCc2c(CC1)cccc2)CC#C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 44mg/kg (44mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 33, Pg. 2111, 1968.