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Substance Name: 3,12-Diaza-6,9-diazoniadispiro(5.2.5.2)hexadecane, 3,12-bis(3-bromo-1-oxopropyl)-, dibromide
RN: 86641-77-2
InChIKey: NUDIXKRVXJCFEO-UHFFFAOYSA-L

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H32-Br2-N4-O2.2Br

Molecular Weight

  • 656.0928
 
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Names and Synonyms

Synonyms

  • 3,12-Bis(3-bromo-1-oxopropyl)-3,12-diaza-6,9-diazoniadispiro(5.2.5.2)hexadecane dibromide
  • N,N'''-Di-(beta-bromopropionyl)-N,N''-dispirotripiperazinium dibromide

Systematic Name

  • 3,12-Diaza-6,9-diazoniadispiro(5.2.5.2)hexadecane, 3,12-bis(3-bromo-1-oxopropyl)-, dibromide

Registry Numbers

CAS Registry Number

  • 86641-77-2

System Generated Number

  • 0086641772

Molecular Formulas

Molecular Formula

  • C18-H32-Br2-N4-O2.2Br

Molecular Formula Fragments

  • Br
  • C18-H32-Br2-N4-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C18H32Br2N4O2.2BrH/c19-3-1-17(25)21-5-9-23(10-6-21)13-15-24(16-14-23)11-7-22(8-12-24)18(26)2-4-20;;/h1-16H2;2*1H/q+2;;/p-2

InChIKey

NUDIXKRVXJCFEO-UHFFFAOYSA-L

Smiles

C1C[N+]2(CCN1C(=O)CCBr)CC[N+]3(CCN(CC3)C(=O)CCBr)CC2.[Br-].[Br-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1150mg/kg (1150mg/kg)   Pharmaceutical Chemistry Journal Vol. 17, Pg. 375, 1983.