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Substance Name: 1,4-Bicyclo(2.2.2)octanebis(methylamine), N,N'-bis(cyclohexylmethyl)-, dihydrochloride
RN: 2169-39-3
InChIKey: LNMLHGDTVHDNQV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H44-N2.2Cl-H

Molecular Weight

  • 433.547
 
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Names and Synonyms

Synonyms

  • Cyclohexanemethylamine, N,N'-(1,4-bicyclo(2.2.2)octylenedimethylene)bis-, dihydrochloride
  • N,N'-(1,4-Bicyclo(2.2.2)octylenedimethylene)bis(cyclohexanemethylamine) dihydrochloride
  • N,N'-Bis(cyclohexylmethyl)-1,4-bicyclo(2.2.2)octanebis(methylamine) dihydrochloride

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 2169-39-3

System Generated Number

  • 0002169393

Molecular Formulas

Molecular Formula

  • C24-H44-N2.2Cl-H

Molecular Formula Fragments

  • C24-H44-N2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C24H44N2.2ClH/c1-3-7-19(8-4-1)15-25-17-23-13-22-12-11-21(23)14-24(22)18-26-16-20-9-5-2-6-10-20;;/h19-26H,1-18H2;2*1H

InChIKey

LNMLHGDTVHDNQV-UHFFFAOYSA-N

Smiles

C1[C@@H]2[C@@H](C[C@@H]([C@@H]1C[NH2+]CC1CCCCC1)CC2)C[NH2+]CC1CCCCC1.[ClH-].[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 650mg/kg (650mg/kg)   Journal of Medicinal Chemistry. Vol. 9, Pg. 329, 1966.