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Substance Name: Pyridinium, 4'-cyclohexylcarbonyl-2-formyl-1,1'-(oxydimethylene)di-, diiodide, 2-oxime
RN: 71752-87-9
InChIKey: AYLQKQJVJPVEIK-UHFFFAOYSA-M

Molecular Formula

  • C20-H25-N3-O3.2I

Molecular Weight

  • 609.235
 
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Names and Synonyms

Synonyms

  • 4'-Cyclohexylcarbonyl-2-formyl-1,1'-(oxydimethylene)dipyridinium diiodide 2-oxime
  • BDB-27
  • Pyridinium, 4'-(cyclohexylcarbonyl)-1,1'-(oxydimethylene)di-, diiodide, 2-oxime

Systematic Name

  • Pyridinium, 4'-cyclohexylcarbonyl-2-formyl-1,1'-(oxydimethylene)di-, diiodide, 2-oxime

Registry Numbers

CAS Registry Number

  • 71752-87-9

Related Registry Number

  • 83972-76-3 (Parent)

System Generated Number

  • 0071752879

Molecular Formulas

Molecular Formula

  • C20-H25-N3-O3.2I

Molecular Formula Fragments

  • C20-H25-N3-O3
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C20H24N3O3.2HI/c24-20(17-6-2-1-3-7-17)18-9-12-22(13-10-18)15-26-16-23-11-5-4-8-19(23)14-21-25;;/h4-5,8-14,17H,1-3,6-7,15-16H2;2*1H/q+1;;/p-1

InChIKey

AYLQKQJVJPVEIK-UHFFFAOYSA-M

Smiles

c1ccc([n+](c1)COC[n+]1ccc(cc1)C(C1CCCCC1)=O)\C=N\O.[IH-].[IH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 179mg/kg (179mg/kg)   Fundamental and Applied Toxicology. Vol. 1, Pg. 203, 1981.