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Substance Name: Ammonium, decamethylenebis(diethyl-(9-fluorenyl)-, dibromide, hemihydrate
RN: 63957-46-0
InChIKey: BNXDKTBMUIPKNM-UHFFFAOYSA-L

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C44-H58-N2.2Br.1/2H2-O

Molecular Weight

  • 774.764
 
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Names and Synonyms

Synonym

  • Decamethylenebis(diethyl-(9-fluorenyl)ammonium) dibromide hemihydrate

Systematic Name

  • Ammonium, decamethylenebis(diethyl-(9-fluorenyl)-, dibromide, hemihydrate

Registry Numbers

CAS Registry Number

  • 63957-46-0

System Generated Number

  • 0063957460

Molecular Formulas

Molecular Formula

  • C44-H58-N2.2Br.1/2H2-O

Molecular Formula Fragments

  • Br
  • C44-H58-N2
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C44H58N2.2BrH/c1-5-45(6-2,43-39-29-19-15-25-35(39)36-26-16-20-30-40(36)43)33-23-13-11-9-10-12-14-24-34-46(7-3,8-4)44-41-31-21-17-27-37(41)38-28-18-22-32-42(38)44;;/h15-22,25-32,43-44H,5-14,23-24,33-34H2,1-4H3;2*1H/q+2;;/p-2

InChIKey

BNXDKTBMUIPKNM-UHFFFAOYSA-L

Smiles

C1([N+](CCCCCCCCCC[N+](C2c3c(cccc3)c3c2cccc3)(CC)CC)(CC)CC)c2c(cccc2)c2c1cccc2.[BrH-].[BrH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 750ug/kg (0.75mg/kg)   Journal of the American Chemical Society. Vol. 76, Pg. 1862, 1954.