chempirical

2-(Perfluorohexyl)ethanol

C8H5F13OCAS 647-42-7364.11 g/mol

Open in Covalent MOL file
OHFFFFFFFFFFFFF
AlcoholAlkyl halide

Properties

Molecular formula
C8H5F13O
Molar mass
364.11 g/mol
Exact mass
364.0133 Da
Density
1.6782 g/mL (at 25 °C)
Boiling point
88–95 °C (at NaN Torr)
logP
4.11Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
6

Identifiers

CAS number
647-42-7
SMILES
OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIKey
GRJRKPMIRMSBNK-UHFFFAOYSA-N
InChI
InChI=1S/C8H5F13O/c9-3(10,1-2-22)4(11,12)5(13,14)6(15,16)7(17,18)8(19,20)21/h22H,1-2H2

Weigh it out

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

Names and synonyms

28 names · show all
  • 1-Octanol, 3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluoro-
  • 3,3,4,4,5,5,6,6,7,7,8,8,8-Tridecafluoro-1-octanol
  • 2-(Perfluorohexyl)ethyl alcohol
  • 2-(Tridecafluorohexyl)ethanol
  • 1,1,2,2-Tetrahydroperfluorooctanol
  • 1H,1H,2H,2H-Perfluorooctan-1-ol
  • Perfluorohexylethanol
  • 1H,1H,2H,2H-Perfluorooctanol
  • Fluowet EA 600
  • A 1620
  • 3,3,4,4,5,5,6,6,7,7,8,8,8-Tridecafluorooctanol
  • 1H,1H,2H,2H-Tridecafluorooctanol
  • 1,1,2,2-Tetrahydrotridecafluorooctanol
  • 1H,1H,2H,2H-Tridecafluoro-n-octanol
  • 1H,1H,2H,2H-Perfluoro-1-octanol
  • 1,1,2,2-Tetrahydroperfluorooctan-1-ol
  • Foralkyl EOH 6
  • 6:2 FTOH
  • Cheminox FA 6
  • 6:2 Fluorotelomer alcohol
  • 1H,1H,2H,2H-Tetrahydroperfluoro-1-octanol
  • 1H,1H,2H,2H-Tridecafluoro-1-octanol
  • TEOH 6
  • Capstone 62AL
  • S 104
  • S 104 (Fluorocompound)
  • Capstone AL 62
  • H 829808

Work with 2-(Perfluorohexyl)ethanol

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

(Perfluorooctyl)ethanol678-39-7100 % similar 2-(Perfluorodecyl)ethanol865-86-1100 % similar 2-(Perfluorobutyl)ethanol2043-47-295 % similar 4,4,5,5,6,6,7,7,8,8,9,9,9-Tridecafluoro-1-nonanol80806-68-477 % similar 1H,1H-Perfluorooctanol307-30-262 % similar 1H,1H-Perfluoroundecan-1-ol307-46-062 % similar 2,2,3,3,4,4,5,5,6,6,7,7,7-Tridecafluoro-1-heptanol375-82-662 % similar 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-Heptadecafluoro-10-iododecane2043-53-057 % similar

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

Elsewhere

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