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Substance Name: 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, 1-(3,3,4,4,5,5,6,6-octafluoro-1-iodohexyl)-
RN: 135587-12-1
InChIKey: ATTJAAXCEFIJKN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H16-F8-I-N-O3-Si

Molecular Weight

  • 529.2324
 
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Names and Synonyms

Synonyms

  • 1-(3,3,4,4,5,5,6,6-Octafluoro-1-iodohexyl)-2,8,9-trioxa-5-aza-1-silabicyclo(3.3.3)undecane
  • BRN 5355276

Systematic Name

  • 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, 1-(3,3,4,4,5,5,6,6-octafluoro-1-iodohexyl)-

Registry Numbers

CAS Registry Number

  • 135587-12-1

System Generated Number

  • 0135587121

Structure Descriptors

InChI

1S/C12H16F8INO3Si/c13-9(14)11(17,18)12(19,20)10(15,16)7-8(21)26-23-4-1-22(2-5-24-26)3-6-25-26/h8-9H,1-7H2

InChIKey

ATTJAAXCEFIJKN-UHFFFAOYSA-N

Smiles

C1CO[Si]2(OCCN1CCO2)C(CC(C(C(C(F)F)(F)F)(F)F)(F)F)I

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 2gm/kg (2000mg/kg)   Pharmaceutical Chemistry Journal Vol. 25, Pg. 405, 1991.