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Substance Name: 1-Piperazineethanol, 4-(2-(2-methyl-1,3-benzodioxol-2-yl)ethyl)-, dihydrochloride
RN: 52400-66-5
InChIKey: BCOBDRNLUOQFFZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H24-N2-O3.2Cl-H

Molecular Weight

  • 365.2984
 
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Names and Synonyms

Synonym

  • 4-(2-(2-Methyl-1,3-benzodioxol-2-yl)ethyl)piperazin-1-yl-2-ethanol dihydrochloride

Systematic Name

  • 1-Piperazineethanol, 4-(2-(2-methyl-1,3-benzodioxol-2-yl)ethyl)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 52400-66-5

System Generated Number

  • 0052400665

Molecular Formulas

Molecular Formula

  • C16-H24-N2-O3.2Cl-H

Molecular Formula Fragments

  • C16-H24-N2-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C16H24N2O3.2ClH/c1-16(20-14-4-2-3-5-15(14)21-16)6-7-17-8-10-18(11-9-17)12-13-19;;/h2-5,19H,6-13H2,1H3;2*1H

InChIKey

BCOBDRNLUOQFFZ-UHFFFAOYSA-N

Smiles

CC1(Oc2ccccc2O1)CCN3CCN(CC3)CCO.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 90mg/kg (90mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 12, Pg. 413, 1977.
rat LD50 intravenous 18500ug/kg (18.5mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 12, Pg. 413, 1977.