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Substance Name: 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, 1-(2,5-dinitrophenoxy)-
RN: 86881-27-8
InChIKey: DWHFWWIHSPHMMJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H15-N3-O8-Si

Molecular Weight

  • 357.3495
 
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Names and Synonyms

Synonyms

  • 1-(2,5-Dinitrophenoxy)-2,8,9-trioxa-5-aza-1-silabicyclo(3.3.3)undecane
  • 1-(2,5-Dinitrophenoxy)silatrane
  • BRN 5645091

Systematic Name

  • 2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, 1-(2,5-dinitrophenoxy)-

Registry Numbers

CAS Registry Number

  • 86881-27-8

System Generated Number

  • 0086881278

Structure Descriptors

InChI

1S/C12H15N3O8Si/c16-14(17)10-1-2-11(15(18)19)12(9-10)23-24-20-6-3-13(4-7-21-24)5-8-22-24/h1-2,9H,3-8H2

InChIKey

DWHFWWIHSPHMMJ-UHFFFAOYSA-N

Smiles

c1cc(c(cc1[N+](=O)[O-])O[Si]23OCCN(CCO2)CCO3)[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1340mg/kg (1340mg/kg) LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION Pharmaceutical Chemistry Journal Vol. 20, Pg. 472, 1986.