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Substance Name: 1-Azabicyclo(2.2.2)octan-3-one, 2-((4-hydroxyphenyl)methyl)-, hydrochloride
RN: 111897-02-0
InChIKey: VOFFFHPNLYVGFH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H17-N-O2.Cl-H

Molecular Weight

  • 267.754
 
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Names and Synonyms

Synonyms

  • 2-((4-Hydroxyphenyl)methyl)-1-azabicyclo(2.2.2)octan-3-one hydrochloride
  • 2-(4-Oxybenzyl)-3-oxoquinuclidine hydrochloride

Systematic Name

  • 1-Azabicyclo(2.2.2)octan-3-one, 2-((4-hydroxyphenyl)methyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 111897-02-0

System Generated Number

  • 0111897020

Molecular Formulas

Molecular Formula

  • C14-H17-N-O2.Cl-H

Molecular Formula Fragments

  • C14-H17-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C14H17NO2.ClH/c16-12-3-1-10(2-4-12)9-13-14(17)11-5-7-15(13)8-6-11;/h1-4,11,13,16H,5-9H2;1H

InChIKey

VOFFFHPNLYVGFH-UHFFFAOYSA-N

Smiles

[NH+]12[C@@H](C(C(CC1)CC2)=O)Cc1ccc(O)cc1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 190mg/kg (190mg/kg) LUNGS, THORAX, OR RESPIRATION: DYSPNEA

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