chempirical

Perfluorohexyl iodide

C6F13ICAS 355-43-1445.95 g/mol

Open in Covalent MOL file
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Alkyl halide

Properties

Molecular formula
C6F13I
Molar mass
445.95 g/mol
Exact mass
445.8837 Da
Melting point
−46 °C
Boiling point
118 °C
logP
5.12Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
4

Identifiers

CAS number
355-43-1
SMILES
FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)I
InChIKey
BULLJMKUVKYZDJ-UHFFFAOYSA-N
InChI
InChI=1S/C6F13I/c7-1(8,3(11,12)5(15,16)17)2(9,10)4(13,14)6(18,19)20

Weigh it out

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

Names and synonyms

14 names · show all
  • Hexane, 1,1,1,2,2,3,3,4,4,5,5,6,6-tridecafluoro-6-iodo-
  • Hexane, tridecafluoro-1-iodo-
  • 1,1,1,2,2,3,3,4,4,5,5,6,6-Tridecafluoro-6-iodohexane
  • Tridecafluoro-1-iodohexane
  • 1-Iodoperfluorohexane
  • Perfluoro-1-iodohexane
  • Tridecafluoro-6-iodohexane
  • Tridecafluorohexyl iodide
  • 1-Iodotridecafluorohexane
  • n-Perfluorohexyl iodide
  • 1-Iodo-1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexane
  • 1,1,2,2,3,3,4,4,5,5,6,6,6-Tridecafluoro-1-iodohexane
  • 6-Iodoperfluorohexane
  • 1-Iodofluorohexane

Work with Perfluorohexyl iodide

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-Pentadecafluoro-7-iodoheptane335-58-0100 % similar Perfluorodecyl iodide423-62-1100 % similar Perfluorooctyl iodide507-63-1100 % similar Perfluorobutyl iodide423-39-294 % similar Perfluoropropyl iodide754-34-778 % similar 1,8-Diiodoperfluorooctane335-70-676 % similar 1,6-Diiodoperfluorohexane375-80-476 % similar 1,4-Diiodoperfluorobutane375-50-871 % similar

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

Same formula

Decafluoro-2-trifluoromethyl-2-iodopentane102780-88-1

Elsewhere

PubChem CAS Common Chemistry NIST WebBook