1-(3,3,4,4,5,5,6,6,6-Nonafluoro-1-iodohexyl)-2,8,9-trioxa-5-aza-1-sila bicyclo(3.3.3)undecane

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Names

[ CAS No. ]:
135587-13-2

[ Name ]:
1-(3,3,4,4,5,5,6,6,6-Nonafluoro-1-iodohexyl)-2,8,9-trioxa-5-aza-1-sila bicyclo(3.3.3)undecane

[Synonym ]:
2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane,1-(3,3,4,4,5,5,6,6,6-nonafluoro-1-iodohexyl)
1-(3,3,4,4,5,5,6,6,6-Nonafluoro-1-iodohexyl)-2,8,9-trioxa-5-aza-1-silabicyclo(3.3.3)undecane

Chemical & Physical Properties

[ Density]:
1.72g/cm3

[ Boiling Point ]:
337.8ºC at 760mmHg

[ Molecular Formula ]:
C12H15F9INO3Si

[ Molecular Weight ]:
547.22800

[ Flash Point ]:
158.1ºC

[ Exact Mass ]:
546.97200

[ PSA ]:
30.93000

[ LogP ]:
3.86320

[ Vapour Pressure ]:
0.000103mmHg at 25°C

[ Index of Refraction ]:
1.45

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
YJ9042000
CHEMICAL NAME :
2,8,9-Trioxa-5-aza-1-silabicyclo(3.3.3)undecane, 1-(3,3,4,4,5,5,6,6,6-nonafluoro-1-iodohexyl)-
CAS REGISTRY NUMBER :
135587-13-2
LAST UPDATED :
199712
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H15-F9-I-N-O3-Si
MOLECULAR WEIGHT :
547.27

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
400 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
PCJOAU Pharmaceutical Chemistry Journal (English Translation). Translation of KHFZAN. (Plenum Pub. Corp., 233 Spring St., New York, NY 10013) No.1- 1967- Volume(issue)/page/year: 25,405,1991

Synthetic Route

Precursor & DownStream

Precursor

  • Perfluorobutyl iodide
  • 1-vinylsilatrane

DownStream


Related Compounds

  • 1-(1-Ethynylcyclopropyl)-2-methoxy-4-nitrobenzene
  • O-[1-(1-phenyl-1H-1,2,3-triazol-4-yl)ethyl]hydroxylamine
  • 1-(2-Chloro-3-fluorophenyl)-3,3-difluorocyclobutan-1-amine
  • 2-[1-(5-methyl-1H-pyrazol-3-yl)cyclobutyl]acetic acid
  • (1R)-1-(3-bromo-4-methylthiophen-2-yl)ethan-1-amine
  • (2S)-4-[1-(propan-2-yl)-1H-pyrazol-4-yl]butan-2-ol
  • Tert-butyl 2-(4-hydroxy-3-nitrophenyl)piperazine-1-carboxylate
  • (1R)-2-amino-1-(4,5-dimethoxy-2-nitrophenyl)ethan-1-ol
  • O-[1-(2-chloro-6-methylphenyl)ethyl]hydroxylamine
  • Methyl 2-Hydroxy-3-(2-isopropylphenyl)propanoate
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