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Substance Name: Phenethylamine, alpha,beta-dimethyl-N-isopropyl-, hydrochloride, threo-
RN: 40960-62-1
InChIKey: ZARWHNZDQUCLGY-MNMPKAIFSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H21-N.Cl-H

Molecular Weight

  • 227.7768
 
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Names and Synonyms

Synonyms

  • threo-2-Isopropylamine-3-phenylbutane hydrochloride
  • threo-alpha,beta-Dimethyl-N-isopropyl-phenethylamine hydrochloride

Systematic Name

  • Phenethylamine, alpha,beta-dimethyl-N-isopropyl-, hydrochloride, threo-

Registry Numbers

CAS Registry Number

  • 40960-62-1

System Generated Number

  • 0040960621

Molecular Formulas

Molecular Formula

  • C13-H21-N.Cl-H

Molecular Formula Fragments

  • C13-H21-N
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C13H21N.ClH/c1-10(2)14-12(4)11(3)13-8-6-5-7-9-13;/h5-12,14H,1-4H3;1H/t11-,12-;/m1./s1

InChIKey

ZARWHNZDQUCLGY-MNMPKAIFSA-N

Smiles

C[C@@H](c1ccccc1)[C@@H](C)NC(C)C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 28mg/kg (28mg/kg) SENSE ORGANS AND SPECIAL SENSES: LACRIMATION: EYE

SKIN AND APPENDAGES (SKIN): HAIR: OTHER

BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)
Journal of Medicinal Chemistry. Vol. 16, Pg. 14, 1973.