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Substance Name: 2-Propyn-1-amine, N,N-bis(1-methylethyl)-3-(4-chlorophenyl)-, hydrochloride
RN: 65126-83-2
InChIKey: XOYAPZTWNQJHQD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H20-Cl-N.Cl-H

Molecular Weight

  • 286.2439
 
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Names and Synonyms

Synonym

  • N,N-Bis(1-methylethyl)-3-(4-chlorophenyl)-2-propyn-1-amine hydrochloride

Systematic Name

  • 2-Propyn-1-amine, N,N-bis(1-methylethyl)-3-(4-chlorophenyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 65126-83-2

System Generated Number

  • 0065126832

Molecular Formulas

Molecular Formula

  • C15-H20-Cl-N.Cl-H

Molecular Formula Fragments

  • C15-H20-Cl-N
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C15H20ClN.ClH/c1-12(2)17(13(3)4)11-5-6-14-7-9-15(16)10-8-14;/h7-10,12-13H,11H2,1-4H3;1H

InChIKey

XOYAPZTWNQJHQD-UHFFFAOYSA-N

Smiles

CC(C)N(CC#Cc1ccc(cc1)Cl)C(C)C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 225mg/kg (225mg/kg) BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Journal of Medicinal Chemistry. Vol. 21, Pg. 253, 1978.