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Substance Name: Ammonium, hexamethylenebis(beta-(9-fluorenyl)ethyl)dimethyl-, dibromide, sesquihydrate
RN: 64011-33-2
InChIKey: FAYHFDMHIOTESQ-UHFFFAOYSA-L

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C40-H50-N2.2Br.3/2H2-O

Molecular Weight

  • 718.657
 
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Names and Synonyms

Synonym

  • Hexamethylenebis((beta-(9-fluorenyl)ethyl)dimethylammonium bromide) sesquihydrate

Systematic Name

  • Ammonium, hexamethylenebis(beta-(9-fluorenyl)ethyl)dimethyl-, dibromide, sesquihydrate

Registry Numbers

CAS Registry Number

  • 64011-33-2

System Generated Number

  • 0064011332

Molecular Formulas

Molecular Formula

  • C40-H50-N2.2Br.3/2H2-O

Molecular Formula Fragments

  • Br
  • C40-H50-N2
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C40H50N2.2BrH/c1-41(2,29-25-39-35-21-11-7-17-31(35)32-18-8-12-22-36(32)39)27-15-5-6-16-28-42(3,4)30-26-40-37-23-13-9-19-33(37)34-20-10-14-24-38(34)40;;/h7-14,17-24,39-40H,5-6,15-16,25-30H2,1-4H3;2*1H/q+2;;/p-2

InChIKey

FAYHFDMHIOTESQ-UHFFFAOYSA-L

Smiles

C1(c2c(cccc2)c2c1cccc2)CC[N+](CCCCCC[N+](CCC1c2c(cccc2)c2c1cccc2)(C)C)(C)C.[BrH-].[BrH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 700mg/kg (700mg/kg)   Journal of the American Chemical Society. Vol. 76, Pg. 1862, 1954.