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Substance Name: Ethanol, 2-(((1,3-benzodioxol-5-yl)ethyl)amino)-1-(5-methyl-2-thienyl)-, hydrochloride
RN: 59160-38-2
InChIKey: GPBHHLQZUDJVGX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H19-N-O3-S.Cl-H

Molecular Weight

  • 341.857
 
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Names and Synonyms

Synonyms

  • 2-(((1,3-Benzodioxol-5-yl)ethyl)amino)-1-(5-methyl-2-thienyl)ethanol hydrochloride
  • 2-Thiophenemethanol, alpha-(((2-(1,3-benzodioxol-5-yl)ethyl)amino)methyl)-5-methyl-, HCl
  • alpha-(3,4-Methylenedioxyphenethylaminomethyl)-5-methyl-2-thienylmethanol hydrochloride

Systematic Name

  • Ethanol, 2-(((1,3-benzodioxol-5-yl)ethyl)amino)-1-(5-methyl-2-thienyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 59160-38-2

System Generated Number

  • 0059160382

Molecular Formulas

Molecular Formula

  • C16-H19-N-O3-S.Cl-H

Molecular Formula Fragments

  • C16-H19-N-O3-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C16H19NO3S.ClH/c1-11-2-5-16(21-11)13(18)9-17-7-6-12-3-4-14-15(8-12)20-10-19-14;/h2-5,8,13,17-18H,6-7,9-10H2,1H3;1H

InChIKey

GPBHHLQZUDJVGX-UHFFFAOYSA-N

Smiles

Cc1ccc(s1)C(CNCCc2ccc3c(c2)OCO3)O.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 40mg/kg (40mg/kg)   Journal of Medicinal Chemistry. Vol. 19, Pg. 876, 1976.