2,2,3,3,4,4,5,5-Octafluorohexane-1,6-diol

C₆H₆F₈O₂CAS 355-74-8262.10 g/mol

Open in Covalent MOL file

Alcohol Alkyl halide

Properties

Molecular formula: C₆H₆F₈O₂
Molar mass: 262.10 g/mol
Exact mass: 262.0240 Da
Melting point: 68 °C
Boiling point: 118–120 °C (at 11 Torr)
logP: 1.51Crippen estimate
Polar surface area: 40.5 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 5

Hazards

Warning

H302 Harmful if swallowed16.7% of notifiers
H312 Harmful in contact with skin16.7% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H332 Harmful if inhaled16.7% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 6 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

355-74-8

SMILES

OCC(F)(F)C(F)(F)C(F)(F)C(F)(F)CO

InChIKey

NHEKBXPLFJSSBZ-UHFFFAOYSA-N

InChI

InChI=1S/C6H6F8O2/c7-3(8,1-15)5(11,12)6(13,14)4(9,10)2-16/h15-16H,1-2H2

Weigh it out

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

Names and synonyms

7 names

2,2,3,3,4,4,5,5-Octafluoro-1,6-hexanediol
1,6-Hexanediol, 2,2,3,3,4,4,5,5-octafluoro-
1,6-Dihydroxy-2,2,3,3,4,4,5,5-octafluorohexane
2,2,3,3,4,4,5,5-Octafluorohexanediol
A 7412
C 6DI0L
1H,1H,6H,6H-Perfluorohexane-1,6-diol

Work with 2,2,3,3,4,4,5,5-Octafluorohexane-1,6-diol

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,12H,12H-Perfluoro-1,12-dodecanediol183162-43-894 % similar 2,2,3,3,4,4,5,5,6,6,7,7,8,8-Tetradecafluoro-1,9-nonanediol203303-01-994 % similar 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-Hexadecafluoro-1,10-decanediol754-96-194 % similar 2,2,3,3,4,4,5,5,6,6,7,7-Dodecafluoro-1,8-octanediol90177-96-194 % similar 2,2,3,3,4,4-Hexafluoro-1,5-pentanediol376-90-988 % similar 1H,1H-Perfluoro-1-tetradecanol15622-57-875 % similar 1H,1H-Perfluorooctanol307-30-275 % similar 1H,1H-Perfluoro-1-decanol307-37-975 % similar

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

Elsewhere

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