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Substance Name: 3-Aza-9-azoniabicyclo(3.3.1)nonane, 3,3'-hexamethylenebis(9,9-dimethyl-, diiodide
RN: 102612-68-0
InChIKey: IELBHPWJHVIEKM-UHFFFAOYSA-L

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H48-N4.2I

Molecular Weight

  • 646.471
 
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Names and Synonyms

Synonyms

  • 1,6-Bis(9-methyl-3,9-diazabicyclo-(3,3,1)-nonane-3)hexane dimethiodide
  • 3,3'-Hexamethylenebis(9,9-dimethyl-3-aza-9-azobicyclo(3.3.1)nonane) diiodide

Systematic Name

  • 3-Aza-9-azoniabicyclo(3.3.1)nonane, 3,3'-hexamethylenebis(9,9-dimethyl-, diiodide

Registry Numbers

CAS Registry Number

  • 102612-68-0

System Generated Number

  • 0102612680

Molecular Formulas

Molecular Formula

  • C24-H48-N4.2I

Molecular Formula Fragments

  • C24-H48-N4
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C24H48N4.2HI/c1-27(2)21-11-9-12-22(27)18-25(17-21)15-7-5-6-8-16-26-19-23-13-10-14-24(20-26)28(23,3)4;;/h21-24H,5-20H2,1-4H3;2*1H/q+2;;/p-2

InChIKey

IELBHPWJHVIEKM-UHFFFAOYSA-L

Smiles

[N+]1([C@@H]2CN(CCCCCCN3C[C@@H]4[N+](C)(C)[C@@H](C3)CCC4)C[C@@H]1CCC2)(C)C.[IH-].[IH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 964ug/kg (0.964mg/kg) BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)

LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES

LUNGS, THORAX, OR RESPIRATION: CYANOSIS
Journal of Medicinal and Pharmaceutical Chemistry. Vol. 3, Pg. 441, 1961.