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Substance Name: 1,4-Cyclohexanebis(methylamine), N,N'-bis(2-hydroxybenzyl)-, diacetate
RN: 2667-70-1
InChIKey: VWRXSXTYPJLXGI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H30-N2-O2.2C2-H4-O2

Molecular Weight

  • 474.594
 
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Names and Synonyms

Synonyms

  • Benzylamine, N,N'-(1,4-cyclohexylenedimethylene)bis(2-hydroxy-, diacetate
  • N,N'-(1,4-Cyclohexylenedimethylene)bis(2-hydroxybenzylamine) diacetate
  • N,N'-Bis(2-hydroxybenzyl)-1,4-cyclohexanebis(methylamine) diacetate

Systematic Name

  • 1,4-Cyclohexanebis(methylamine), N,N'-bis(2-hydroxybenzyl)-, diacetate

Registry Numbers

CAS Registry Number

  • 2667-70-1

System Generated Number

  • 0002667701

Molecular Formulas

Molecular Formula

  • C22-H30-N2-O2.2C2-H4-O2

Molecular Formula Fragments

  • C2-H4-O2
  • C22-H30-N2-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C22H30N2O2.2C2H4O2/c25-21-7-3-1-5-19(21)15-23-13-17-9-11-18(12-10-17)14-24-16-20-6-2-4-8-22(20)26;2*1-2(3)4/h1-8,17-18,23-26H,9-16H2;2*1H3,(H,3,4)

InChIKey

VWRXSXTYPJLXGI-UHFFFAOYSA-N

Smiles

c1(c(cccc1)O)CNCC1CCC(CC1)CNCc1c(O)cccc1.C(C)(O)=O.C(C)(O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 376mg/kg (376mg/kg)   Journal of Medicinal Chemistry. Vol. 9, Pg. 329, 1966.