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Substance Name: 1,3-Benzodioxole, 2-(2-(2-(dimethylamino)ethylamino)ethyl)-2-methyl-, dihydrochloride
RN: 52400-61-0
InChIKey: VLMFACWRYMEGRD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H22-N2-O2.2Cl-H

Molecular Weight

  • 323.262
 
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Names and Synonyms

Synonym

  • 2-(2-(2-(Dimethylamino)ethylamino)ethyl)-2-methyl-1,3-benzodioxole dihydrochloride

Systematic Name

  • 1,3-Benzodioxole, 2-(2-(2-(dimethylamino)ethylamino)ethyl)-2-methyl-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 52400-61-0

System Generated Number

  • 0052400610

Molecular Formulas

Molecular Formula

  • C14-H22-N2-O2.2Cl-H

Molecular Formula Fragments

  • C14-H22-N2-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C14H22N2O2.2ClH/c1-14(8-9-15-10-11-16(2)3)17-12-6-4-5-7-13(12)18-14;;/h4-7,15H,8-11H2,1-3H3;2*1H

InChIKey

VLMFACWRYMEGRD-UHFFFAOYSA-N

Smiles

C1(Oc2ccccc2O1)(CC[NH2+]CC[NH+](C)C)C.[ClH-].[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 175mg/kg (175mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 12, Pg. 413, 1977.
rat LD50 intravenous 51mg/kg (51mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 12, Pg. 413, 1977.