chempirical

Nonafluorohexyltriethoxysilane

C12H19F9O3SiCAS 102390-98-7410.35 g/mol

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Alkyl halideSilyl ether

Properties

Molecular formula
C12H19F9O3Si
Molar mass
410.35 g/mol
Exact mass
410.0960 Da
logP
4.89Crippen estimate
Polar surface area
27.7 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
11

Identifiers

CAS number
102390-98-7
SMILES
CCO[Si](CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)F)(OCC)OCC
InChIKey
NYIKUOULKCEZDO-UHFFFAOYSA-N
InChI
InChI=1S/C12H19F9O3Si/c1-4-22-25(23-5-2,24-6-3)8-7-9(13,14)10(15,16)11(17,18)12(19,20)21/h4-8H2,1-3H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

7 names
  • Silane, triethoxy(3,3,4,4,5,5,6,6,6-nonafluorohexyl)-
  • Triethoxy(3,3,4,4,5,5,6,6,6-nonafluorohexyl)silane
  • 1,1,2,2-Tetrahydroperfluorohexyltriethoxysilane
  • Nonafluorobutylethyltriethoxysilane
  • 2-Perfluorobutylethyltriethoxysilane
  • SIN 6597.65
  • Triethoxy(1H,1H,2H,2H-nonafluorohexyl)silane

Work with Nonafluorohexyltriethoxysilane

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1H,1H,2H,2H-Perfluorodecyltriethoxysilane101947-16-497 % similar 1H,1H,2H,2H-Perfluorooctyltriethoxysilane51851-37-797 % similar Nonafluorohexyltrimethoxysilane85877-79-864 % similar Heptadecafluorodecyltrimethoxysilane83048-65-162 % similar Tridecafluorooctyltrimethoxysilane85857-16-562 % similar 1H,1H,2H,2H-Perfluorooctyldimethylchlorosilane102488-47-153 % similar Perfluorodecyltrichlorosilane78560-44-851 % similar (Tridecafluoro-1,1,2,2-tetrahydrooctyl)trichlorosilane78560-45-951 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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