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Substance Name: 1,4-Cyclohexanebis(methylamine), N,N'-bis(3,7-dimethyloctyl)-, dihydrochloride
RN: 64011-73-0
InChIKey: NDGNUJLGXYAGOV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C28-H58-N2.2Cl-H

Molecular Weight

  • 495.702
 
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Names and Synonyms

Synonyms

  • N,N'-(1,4-Cyclohexylenedimethylene)bis(3,7-dimethyloctylamine) dihydrochloride
  • N,N'-Bis(3,7-dimethyloctyl)-1,4-cyclohexanebis(methylamine) dihydrochloride
  • Octylamine, N,N'-(1,4-cyclohexylenedimethylene)bis(3,7-dimethyl-, dihydrochloride

Systematic Name

  • 1,4-Cyclohexanebis(methylamine), N,N'-bis(3,7-dimethyloctyl)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 64011-73-0

System Generated Number

  • 0064011730

Molecular Formulas

Molecular Formula

  • C28-H58-N2.2Cl-H

Molecular Formula Fragments

  • C28-H58-N2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C28H58N2.2ClH/c1-23(2)9-7-11-25(5)17-19-29-21-27-13-15-28(16-14-27)22-30-20-18-26(6)12-8-10-24(3)4;;/h23-30H,7-22H2,1-6H3;2*1H

InChIKey

NDGNUJLGXYAGOV-UHFFFAOYSA-N

Smiles

N(CC1CCC(CC1)CNCC[C@@H](CCCC(C)C)C)CC[C@@H](CCCC(C)C)C.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1041mg/kg (1041mg/kg)   Journal of Medicinal Chemistry. Vol. 9, Pg. 329, 1966.