1-Bromo-1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoroheptane
Properties
- Molecular formula
- C7BrF15
- Molar mass
- 448.96 g/mol
- Exact mass
- 447.8944 Da
- Boiling point
- 118 °C
- logP
- 5.71Crippen estimate
- Polar surface area
- 0.0 Ų
- H-bond donors / acceptors
- 0 / 0
- Rotatable bonds
- 5
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation97.7% of notifiers
Aggregated from 44 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
375-88-2SMILES
FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)BrInChIKey
VPQQZKWYZYVTMU-UHFFFAOYSA-NInChI
InChI=1S/C7BrF15/c8-6(19,20)4(15,16)2(11,12)1(9,10)3(13,14)5(17,18)7(21,22)23Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
6 names
- Heptane, 1-bromo-1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoro-
- Heptane, 1-bromopentadecafluoro-
- Pentadecafluoro-1-bromoheptane
- 1-Bromopentadecafluoroheptane
- Perfluoroheptyl bromide
- 1-Bromoperfluoroheptane
Work with 1-Bromo-1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoroheptane
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
Perfluorooctyl bromide423-55-2100 % 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.