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Substance Name: 1,4-Cyclohexanebis(methylamine), N,N'-bis(2,3-dimethoxybenzyl)-, dihydrochloride
RN: 1257-13-2
InChIKey: CCDDAZAJRNNGBK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H38-N2-O4.2Cl-H

Molecular Weight

  • 515.518
 
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Names and Synonyms

Synonyms

  • Benzylamine, N,N'-(1,4-cyclohexylenedimethylene)bis(2,3-dimethoxy-, dihydrochloride
  • N,N'-(1,4-Cyclohexylenedimethylene)bis(2,3-dimethoxybenzylamine) dihydrochloride
  • N,N'-Bis(2,3-dimethoxybenzyl)-1,4-cyclohexanebis(methylamine) dihydrochloride

Systematic Name

  • 1,4-Cyclohexanebis(methylamine), N,N'-bis(2,3-dimethoxybenzyl)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 1257-13-2

System Generated Number

  • 0001257132

Molecular Formulas

Molecular Formula

  • C26-H38-N2-O4.2Cl-H

Molecular Formula Fragments

  • C26-H38-N2-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C26H38N2O4.2ClH/c1-29-23-9-5-7-21(25(23)31-3)17-27-15-19-11-13-20(14-12-19)16-28-18-22-8-6-10-24(30-2)26(22)32-4;;/h5-10,19-20,27-28H,11-18H2,1-4H3;2*1H

InChIKey

CCDDAZAJRNNGBK-UHFFFAOYSA-N

Smiles

c1(c(CNCC2CCC(CC2)CNCc2c(c(OC)ccc2)OC)cccc1OC)OC.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 750mg/kg (750mg/kg)   Journal of Medicinal Chemistry. Vol. 9, Pg. 329, 1966.