chempirical

1,4-Diiodoperfluorobutane

C4F8I2CAS 375-50-8453.84 g/mol

Open in Covalent MOL file
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Alkyl halide

Properties

Molecular formula
C4F8I2
Molar mass
453.84 g/mol
Exact mass
453.7962 Da
Density
2.4739 g/mL (at 27 °C)
Melting point
−9 °C
Boiling point
150 °C
logP
4.31Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
3

Identifiers

CAS number
375-50-8
SMILES
FC(F)(I)C(F)(F)C(F)(F)C(F)(F)I
InChIKey
JILAKKYYZPDQBE-UHFFFAOYSA-N
InChI
InChI=1S/C4F8I2/c5-1(6,3(9,10)13)2(7,8)4(11,12)14

Weigh it out

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

Names and synonyms

7 names
  • Butane, 1,1,2,2,3,3,4,4-octafluoro-1,4-diiodo-
  • Butane, octafluoro-1,4-diiodo-
  • 1,1,2,2,3,3,4,4-Octafluoro-1,4-diiodobutane
  • Octafluoro-1,4-diiodobutane
  • 1,4-Diiodooctafluorobutane
  • 1,4-Diiodo-1,1,2,2,3,3,4,4-octafluorobutane
  • α,ω-Diiodoperfluorobutane

Work with 1,4-Diiodoperfluorobutane

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

1,8-Diiodoperfluorooctane335-70-692 % similar 1,6-Diiodoperfluorohexane375-80-492 % similar Perfluorobutyl iodide423-39-275 % similar 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-Pentadecafluoro-7-iodoheptane335-58-071 % similar Perfluorohexyl iodide355-43-171 % similar Perfluorodecyl iodide423-62-171 % similar Perfluorooctyl iodide507-63-171 % similar Perfluoropropyl iodide754-34-769 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook