chempirical

1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-Heptadecafluoro-10-iododecane

C10H4F17ICAS 2043-53-0574.02 g/mol

Open in Covalent MOL file
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Alkyl halide

Properties

Molecular formula
C10H4F17I
Molar mass
574.02 g/mol
Exact mass
573.9086 Da
Melting point
50 °C
Boiling point
90–91 °C (at 10 Torr)
logP
6.82Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
8

Identifiers

CAS number
2043-53-0
SMILES
FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)CCI
InChIKey
XVKJSLBVVRCOIT-UHFFFAOYSA-N
InChI
InChI=1S/C10H4F17I/c11-3(12,1-2-28)4(13,14)5(15,16)6(17,18)7(19,20)8(21,22)9(23,24)10(25,26)27/h1-2H2

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

Names and synonyms

16 names · show all
  • 1-Iodo-3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecane
  • 1-Iodo-2-(perfluorooctyl)ethane
  • 1H,1H,2H,2H-Perfluorodecyl iodide
  • 10-Iodo-1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-heptadecafluorodecane
  • Decane, 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-heptadecafluoro-10-iodo-
  • 1-Iodo-1,1,2,2-tetrahydroperfluorodecane
  • 1,1,2,2-Tetrahydroperfluorodecyl iodide
  • 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-Heptadecafluorodecyl iodide
  • 1-(2-Iodoethyl)heptadecafluorooctane
  • 2-(Perfluorooctyl)ethyl iodide
  • 1-(Perfluorooctyl)-2-iodoethane
  • 2-(n-Perfluorooctyl)ethyl iodide
  • 1-Iodo-1H,1H,2H,2H-perfluorodecane
  • 1H,1H,2H,2H-Heptadecaflurorodecyl iodide
  • Perfluorooctylethyl iodide
  • 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-Heptadecafluoro-1-iododecane

Work with 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-Heptadecafluoro-10-iododecane

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

1-Iodo-1H,1H,2H,2H-perfluorododecane2043-54-1100 % similar 1,1,1,2,2,3,3,4,4,5,5,6,6-Tridecafluoro-8-iodooctane2043-57-4100 % similar 1,1,1,2,2,3,3,4,4-Nonafluoro-6-iodohexane2043-55-295 % similar 1,1,1,2,2-Pentafluoro-4-iodobutane40723-80-663 % similar 3,3,4,4,5,5,6,6,7,7,8,8,8-Tridecafluoro-1-octanethiol34451-26-857 % similar 2-(Perfluorohexyl)ethanol647-42-757 % similar (Perfluorooctyl)ethanol678-39-757 % similar 2-(Perfluorobutyl)ethanol2043-47-254 % similar

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

Elsewhere

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