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Substance Name: 2-Propyn-1-amine, N,N-dimethyl-3-(3-(trifluoromethyl)phenyl)-, hydrochloride
RN: 65126-77-4
InChIKey: JZNFXTGLNKBARY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H12-F3-N.Cl-H

Molecular Weight

  • 263.6887
 
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Names and Synonyms

Synonym

  • N,N-Dimethyl-3-(3-(trifluoromethyl)phenyl)-2-propyn-1-amine hydrochloride

Systematic Name

  • 2-Propyn-1-amine, N,N-dimethyl-3-(3-(trifluoromethyl)phenyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 65126-77-4

System Generated Number

  • 0065126774

Molecular Formulas

Molecular Formula

  • C12-H12-F3-N.Cl-H

Molecular Formula Fragments

  • C12-H12-F3-N
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C12H12F3N.ClH/c1-16(2)8-4-6-10-5-3-7-11(9-10)12(13,14)15;/h3,5,7,9H,8H2,1-2H3;1H

InChIKey

JZNFXTGLNKBARY-UHFFFAOYSA-N

Smiles

CN(C)CC#Cc1cccc(c1)C(F)(F)F.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 200mg/kg (200mg/kg)   Journal of Medicinal Chemistry. Vol. 21, Pg. 253, 1978.