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Substance Name: 1,4-Bicyclo(2.2.2)octanebis(methylamine), N,N'-bis(1-indanyl)-, dihydrochloride
RN: 5085-35-8
InChIKey: VTMUHKQETIHHIO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C28-H36-N2.2Cl-H

Molecular Weight

  • 473.528
 
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Names and Synonyms

Synonyms

  • 1-Indanamine, N,N'-(1,4-bicyclo(2.2.2)octylenedimethylene)di-, dihydrochloride
  • N,N'-(1,4-Bicyclo(2.2.2)octylenedimethylene)di(1-indanamine) dihydrochloride
  • N,N'-Bis(1-indanyl)-1,4-bicyclo(2.2.2)octanebis(methylamine) dihydrochloride

Systematic Name

  • 1,4-Bicyclo(2.2.2)octanebis(methylamine), N,N'-bis(1-indanyl)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 5085-35-8

System Generated Number

  • 0005085358

Molecular Formulas

Molecular Formula

  • C28-H36-N2.2Cl-H

Molecular Formula Fragments

  • C28-H36-N2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C28H36N2.2ClH/c1-3-7-23-21(5-1)9-11-25(23)29-19-27-13-16-28(17-14-27,18-15-27)20-30-26-12-10-22-6-2-4-8-24(22)26;;/h1-8,25-26,29-30H,9-20H2;2*1H

InChIKey

VTMUHKQETIHHIO-UHFFFAOYSA-N

Smiles

C12(CCC(C[NH2+][C@@H]3c4c(cccc4)CC3)(CC1)CC2)C[NH2+][C@@H]1c2c(cccc2)CC1.[ClH-].[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 753mg/kg (753mg/kg)   Journal of Medicinal Chemistry. Vol. 9, Pg. 329, 1966.