1,4-Dibromooctafluorobutane

C₄Br₂F₈CAS 335-48-8359.84 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₄Br₂F₈
Molar mass: 359.84 g/mol
Exact mass: 357.8239 Da
logP: 4.23Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 3

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers

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

Precautionary statements

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364

Identifiers

CAS number

335-48-8

SMILES

C(C(C(F)(F)Br)(F)F)(C(F)(F)Br)(F)F

InChIKey

RWWUGYJWSVESJC-UHFFFAOYSA-N

InChI

InChI=1S/C4Br2F8/c5-3(11,12)1(7,8)2(9,10)4(6,13)14

Weigh it out

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

Work with 1,4-Dibromooctafluorobutane

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

1,8-Dibromoperfluorooctane812-58-892 % similar 1,6-Dibromododecafluorohexane918-22-992 % similar 1-Bromononafluorobutane375-48-480 % similar 1-Bromoperfluorohexane335-56-875 % similar 1-Bromo-1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoroheptane375-88-275 % similar Perfluorooctyl bromide423-55-275 % similar Nonadecafluorononyl bromide558-96-375 % similar 1-Bromo-1,1,2,2,3,3,3-heptafluoropropane422-85-569 % similar

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

Elsewhere

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