chempirical

1,1,2,2,3,3,4,4-Octafluoro-5-iodopentane

C5H3F8ICAS 678-74-0341.97 g/mol

Open in Covalent MOL file
FFFFFFFFI
Alkyl halide

Properties

Molecular formula
C5H3F8I
Molar mass
341.97 g/mol
Exact mass
341.9152 Da
logP
3.59Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
4

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
678-74-0
SMILES
C(C(C(C(C(F)F)(F)F)(F)F)(F)F)I
InChIKey
YMGYSVVJRMSEGU-UHFFFAOYSA-N
InChI
InChI=1S/C5H3F8I/c6-2(7)4(10,11)5(12,13)3(8,9)1-14/h2H,1H2

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Names and synonyms

1 names
  • 1H,1H,5H-Octafluoropentyl iodide

Work with 1,1,2,2,3,3,4,4-Octafluoro-5-iodopentane

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,7H-Dodecafluoroheptyl iodide376-32-985 % similar 2,2,3,3,4,4,5,5-Octafluoro-1-pentanol355-80-659 % similar 1,1,2,2,3,3,4,4,5,5,6,6-Dodecafluorohexane336-07-254 % similar 1H,1H,5H-Perfluoropentyl-1,1,2,2-tetrafluoroethylether16627-71-753 % similar 1,1,1,2,2,3,3-Heptafluoro-4-iodobutane374-98-152 % similar 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11-Eicosafluoro-1-undecanol307-70-050 % similar 2,2,3,3,4,4,5,5,6,6,7,7-Dodecafluoro-1-heptanol335-99-950 % similar Tris(2,2,3,3,4,4,5,5-octafluoropentyl) phosphate355-86-250 % similar

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

Elsewhere

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