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Substance Name: 1,2-Benzenediol, 4-(2-((1,3-benzodioxol-5-ylmethyl)amino)ethyl)-, hydrochloride
RN: 56114-10-4
InChIKey: IZMVNVIJWVUJIF-UHFFFAOYSA-N

Molecular Formula

  • C16-H17-N-O4.Cl-H

Molecular Weight

  • 323.7742
 
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Names and Synonyms

Synonyms

  • 3,4-Dihydroxybenzyl-3',4'-dihydroxy-beta-phenylethylamine hydrochloride
  • 4-(2-((1,3-Benzodioxol-5-ylmethyl)amino)ethyl)-1,2-benzenediol hydrochloride
  • Pyrocatechol, 4-(2-piperonylaminoethyl)-, hydrochloride

Systematic Name

  • 1,2-Benzenediol, 4-(2-((1,3-benzodioxol-5-ylmethyl)amino)ethyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 56114-10-4

System Generated Number

  • 0056114104

Molecular Formulas

Molecular Formula

  • C16-H17-N-O4.Cl-H

Molecular Formula Fragments

  • C16-H17-N-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C16H17NO4.ClH/c18-13-3-1-11(7-14(13)19)5-6-17-9-12-2-4-15-16(8-12)21-10-20-15;/h1-4,7-8,17-19H,5-6,9-10H2;1H

InChIKey

IZMVNVIJWVUJIF-UHFFFAOYSA-N

Smiles

c1cc(c(cc1CCNCc2ccc3c(c2)OCO3)O)O.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intraperitoneal 202mg/kg (202mg/kg) BEHAVIORAL: EXCITEMENT

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Journal of Pharmacology and Experimental Therapeutics. Vol. 50, Pg. 131, 1934.