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Substance Name: 1-Azabicyclo(2.2.2)octane, 2-(1,3-benzodioxol-5-ylmethyl)-, hydrochloride
RN: 111897-07-5
InChIKey: LNBXDCSOFJIZJF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H19-N-O2.Cl-H

Molecular Weight

  • 281.781
 
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Names and Synonyms

Synonyms

  • 2-(1,3-Benzodioxol-5-ylmethyl)-1-azabicyclo(2.2.2)octane hydrochloride
  • 2-(3,4-Methylenedioxybenzyl)quinuclidine hydrochloride

Systematic Name

  • 1-Azabicyclo(2.2.2)octane, 2-(1,3-benzodioxol-5-ylmethyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 111897-07-5

System Generated Number

  • 0111897075

Molecular Formulas

Molecular Formula

  • C15-H19-N-O2.Cl-H

Molecular Formula Fragments

  • C15-H19-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C15H19NO2.ClH/c1-2-14-15(18-10-17-14)9-12(1)8-13-7-11-3-5-16(13)6-4-11;/h1-2,9,11,13H,3-8,10H2;1H

InChIKey

LNBXDCSOFJIZJF-UHFFFAOYSA-N

Smiles

[NH+]12[C@@H](Cc3cc4c(OCO4)cc3)CC(CC1)CC2.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 25mg/kg (25mg/kg) LUNGS, THORAX, OR RESPIRATION: DYSPNEA

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Pharmaceutical Chemistry Journal Vol. 21, Pg. 484, 1987.