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Substance Name: 1-Piperazinepropanol, alpha-(p-chlorophenyl)-4-(beta-methoxyphenethyl)-, dihydrochloride
RN: 27588-47-2
InChIKey: JPGWYOJBMMBLFX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H29-Cl-N2-O2.2Cl-H

Molecular Weight

  • 461.858
 
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Names and Synonyms

Synonym

  • alpha-(p-Chlorophenyl)-4-(beta-methoxyphenethyl)-1-piperazinepropanol dihydrochloride

Systematic Name

  • 1-Piperazinepropanol, alpha-(p-chlorophenyl)-4-(beta-methoxyphenethyl)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 27588-47-2

System Generated Number

  • 0027588472

Molecular Formulas

Molecular Formula

  • C22-H29-Cl-N2-O2.2Cl-H

Molecular Formula Fragments

  • C22-H29-Cl-N2-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H29ClN2O2.2ClH/c1-27-22(19-5-3-2-4-6-19)17-25-15-13-24(14-16-25)12-11-21(26)18-7-9-20(23)10-8-18;;/h2-10,21-22,26H,11-17H2,1H3;2*1H

InChIKey

JPGWYOJBMMBLFX-UHFFFAOYSA-N

Smiles

N1(CCN(CC1)C[C@@H](c1ccccc1)OC)CC[C@@H](O)c1ccc(cc1)Cl.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 718mg/kg (718mg/kg)   United States Patent Document. Vol. #3705244,