1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-Heptadecafluorooctane

C8HF17CAS 335-65-9420.07 g/mol

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Alkyl halide

Properties

Molecular formula
C8HF17
Molar mass
420.07 g/mol
Exact mass
419.9807 Da
Density
1.76 g/mL (at 25 °C)
Boiling point
118–119 °C
logP
5.63Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
6

Hazards

Warning
Irritant (GHS07)

Aggregated from 41 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
335-65-9
SMILES
FC(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIKey
KBHBUUBXEQUIMV-UHFFFAOYSA-N
InChI
InChI=1S/C8HF17/c9-1(10)2(11,12)3(13,14)4(15,16)5(17,18)6(19,20)7(21,22)8(23,24)25/h1H

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

Names and synonyms

3 names
  • Octane, 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-heptadecafluoro-
  • 1H-Perfluorooctane
  • 1-Hydroperfluorooctane

Work with 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-Heptadecafluorooctane

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

1H-Perfluoroheptane27213-61-2100 % similar 1H-Perfluorohexane355-37-3100 % similar 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10-Heneicosafluorodecane375-97-3100 % similar 1,1,2,2,3,3,4,4,5,5,6,6-Dodecafluorohexane336-07-274 % similar 1-Bromo-1,1,2,2,3,3,4,4,5,5,6,6-dodecafluorohexane355-36-264 % similar Perfluoropentadecane2264-03-153 % similar Perfluorooctane307-34-653 % similar Perfluorododecane307-59-553 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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