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Substance Name: 1,4-Cyclohexanebis(methylamine), N,N'-bis(3,4-dichlorobenzyl)-, dihydrochloride
RN: 1250-77-7
InChIKey: WAGUALLVPHOILS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H26-Cl4-N2.2Cl-H

Molecular Weight

  • 533.195
 
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Names and Synonyms

Synonyms

  • Benzylamine, N,N'-(1,4-cyclohexylenedimethylene)bis(3,4-dichloro-, dihydrochloride
  • N,N'-(1,4-Cyclohexylenedimethylene)bis(3,4-dichlorobenzylamine) dihydrochloride
  • N,N'-Bis(3,4-dichlorobenzyl)-1,4-cyclohexanebis(methylamine) dihydrochloride

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 1250-77-7

System Generated Number

  • 0001250777

Molecular Formulas

Molecular Formula

  • C22-H26-Cl4-N2.2Cl-H

Molecular Formula Fragments

  • C22-H26-Cl4-N2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H26Cl4N2.2ClH/c23-19-7-5-17(9-21(19)25)13-27-11-15-1-2-16(4-3-15)12-28-14-18-6-8-20(24)22(26)10-18;;/h5-10,15-16,27-28H,1-4,11-14H2;2*1H

InChIKey

WAGUALLVPHOILS-UHFFFAOYSA-N

Smiles

c1(c(ccc(c1)CNCC1CCC(CC1)CNCc1cc(Cl)c(cc1)Cl)Cl)Cl.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 124mg/kg (124mg/kg)   Journal of Medicinal Chemistry. Vol. 9, Pg. 329, 1966.