2,2,3,3,4,4,5,5-Octafluoro-1-pentanol
Properties
- Molecular formula
- C5H4F8O
- Molar mass
- 232.07 g/mol
- Exact mass
- 232.0134 Da
- Density
- 1.667 g/mL (at 20 °C)
- Melting point
- −65 °C
- Boiling point
- 140.5 °C
- logP
- 2.15Crippen estimate
- Polar surface area
- 20.2 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 4
Hazards
Warning
- H315 Causes skin irritation90.6% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation98.4% of notifiers
Aggregated from 64 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
355-80-6SMILES
OCC(F)(F)C(F)(F)C(F)(F)C(F)FInChIKey
JUGSKHLZINSXPQ-UHFFFAOYSA-NInChI
InChI=1S/C5H4F8O/c6-2(7)4(10,11)5(12,13)3(8,9)1-14/h2,14H,1H2Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
14 names · show all
- 1-Pentanol, 2,2,3,3,4,4,5,5-octafluoro-
- 1H,1H,5H-Octafluoro-1-pentanol
- 2,2,3,3,4,4,5,5-Octafluoropentanol
- 1,1,5-Trihydrooctafluoropentan-1-ol
- 1,1,5-Trihydrooctafluoropentyl alcohol
- α,α,ω-Trihydroperfluoropentanol
- 1H,1H,5H-Octafluoro-n-pentanol
- NSC 114
- 1,1,5-Trihydro-1-hydroxyperfluoropentane
- 1,1,5-Trihydroperfluoropentanol
- 1H,1H,5H-Perfluoropentanol
- 1H,1H,5H-Perfluoro-1-pentanol
- 1,1,5-Trihydroperfluoropentan-1-ol
- 1,1,2,2,3,3,4,4-Octafluoropentan-5-ol
Work with 2,2,3,3,4,4,5,5-Octafluoro-1-pentanol
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
2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11-Eicosafluoro-1-undecanol307-70-085 % similar
2,2,3,3,4,4,5,5,6,6,7,7-Dodecafluoro-1-heptanol335-99-985 % similar
2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-Hexadecafluoro-1-nonanol376-18-185 % similar
1H,1H,13H-Perfluorotridecan-1-ol423-72-385 % similar
1,1,2,2,3,3,4,4-Octafluoro-5-iodopentane678-74-059 % similar
2,2,3,3,4,4,5,5-Octafluorohexane-1,6-diol355-74-858 % similar
2,2,3,3,4,4-Hexafluoro-1,5-pentanediol376-90-958 % similar
1H,1H,12H,12H-Perfluoro-1,12-dodecanediol183162-43-856 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.