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Substance Name: 3-Azabicyclo(3.2.1)octane, 3-(p-aminobenzyl)-1,8,8-trimethyl-, dihydrochloride
RN: 1220-31-1
InChIKey: JXFXQBRHCQGLBM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H26-N2.2Cl-H

Molecular Weight

  • 331.328
 
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Names and Synonyms

Synonym

  • 3-(p-Aminobenzyl)-1,8,8-trimethyl-3-azabicyclo(3.2.1)octane dihydrochloride

Systematic Name

  • 3-Azabicyclo(3.2.1)octane, 3-(p-aminobenzyl)-1,8,8-trimethyl-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 1220-31-1

System Generated Number

  • 0001220311

Molecular Formulas

Molecular Formula

  • C17-H26-N2.2Cl-H

Molecular Formula Fragments

  • C17-H26-N2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C17H26N2.2ClH/c1-16(2)14-8-9-17(16,3)12-19(11-14)10-13-4-6-15(18)7-5-13;;/h4-7,14H,8-12,18H2,1-3H3;2*1H

InChIKey

JXFXQBRHCQGLBM-UHFFFAOYSA-N

Smiles

C1([C@@]2(C[N@@H+](Cc3ccc([NH2+])cc3)C[C@@H]1CC2)C)(C)C.[ClH-].[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 104mg/kg (104mg/kg)   Yakugaku Zasshi. Journal of Pharmacy. Vol. 84, Pg. 918, 1964.