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Substance Name: Propiophenone, 4'-(2-hydroxy-3-(alpha-methylphenethylamino)propoxy)-, hydrochloride
RN: 36116-02-6
InChIKey: HLPDBHAKOVQMKQ-UHFFFAOYSA-N

Molecular Formula

  • C21-H27-N-O3.Cl-H

Molecular Weight

  • 377.909
 
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Names and Synonyms

Synonyms

  • 3-(1-Methyl-2-phenylethylamino)-1-(4-propionylphenoxy)propan-2-ol hydrochloride
  • 4'-(2-Hydroxy-3-(alpha-methylphenethylamino)propoxy)propiophenone hydrochloride

Systematic Name

  • Propiophenone, 4'-(2-hydroxy-3-(alpha-methylphenethylamino)propoxy)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 36116-02-6

System Generated Number

  • 0036116026

Molecular Formulas

Molecular Formula

  • C21-H27-N-O3.Cl-H

Molecular Formula Fragments

  • C21-H27-N-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C21H27NO3.ClH/c1-3-21(24)18-9-11-20(12-10-18)25-15-19(23)14-22-16(2)13-17-7-5-4-6-8-17;/h4-12,16,19,22-23H,3,13-15H2,1-2H3;1H

InChIKey

HLPDBHAKOVQMKQ-UHFFFAOYSA-N

Smiles

C(c1ccc(OC[C@@H](CN[C@@H](Cc2ccccc2)C)O)cc1)(=O)CC.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 150mg/kg (150mg/kg)   Journal of Medicinal Chemistry. Vol. 15, Pg. 286, 1972.