Perfluorooctyl bromide

C8BrF17CAS 423-55-2498.96 g/mol

Open in Covalent MOL file
FFFFFFFFFFFFFFFFFBr
Alkyl halide

Properties

Molecular formula
C8BrF17
Molar mass
498.96 g/mol
Exact mass
497.8912 Da
Density
1.93 g/mL
Melting point
below 25 °C
Boiling point
141 °C
logP
6.35Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
6

Hazards

Warning
Irritant (GHS07)

Aggregated from 55 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
423-55-2
SMILES
FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)Br
InChIKey
WTWWXOGTJWMJHI-UHFFFAOYSA-N
InChI
InChI=1S/C8BrF17/c9-7(22,23)5(18,19)3(14,15)1(10,11)2(12,13)4(16,17)6(20,21)8(24,25)26

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Names and synonyms

18 names · show all
  • Oxygent HT
  • Foralkyl br 8
  • AF 0104
  • AFO 150
  • FO 6167
  • Octane, 1-bromo-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluoro-
  • Octane, 1-bromoheptadecafluoro-
  • 1-Bromo-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctane
  • Perfluoroctyl bromide
  • 1-Bromoperfluorooctane
  • Imagent
  • PFOB
  • Perflubron
  • Imagent BP
  • Oxygent
  • Oxygent CA
  • n-Perfluorooctyl bromide
  • 1-Bromoheptadecafluorooctane

Work with Perfluorooctyl bromide

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

1-Bromoperfluorohexane335-56-8100 % similar 1-Bromo-1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoroheptane375-88-2100 % similar Nonadecafluorononyl bromide558-96-3100 % similar 1-Bromononafluorobutane375-48-494 % similar 1-Bromo-1,1,2,2,3,3,3-heptafluoropropane422-85-582 % similar 1,8-Dibromoperfluorooctane812-58-881 % similar 1,6-Dibromododecafluorohexane918-22-981 % similar 1,4-Dibromooctafluorobutane335-48-875 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook