1-Bromo-1,1,2,2,3,3,3-heptafluoropropane

C3BrF7CAS 422-85-5248.93 g/mol

Open in Covalent MOL file
FFFFFFFBr
Alkyl halide

Properties

Molecular formula
C3BrF7
Molar mass
248.93 g/mol
Exact mass
247.9072 Da
Boiling point
11–12 °C
logP
3.17Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from the 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, P321, P330, P332+P317, P337+P317, P362+P364, P501

Identifiers

CAS number
422-85-5
SMILES
FC(F)(F)C(F)(F)C(F)(F)Br
InChIKey
LANNRYWUUQMNPF-UHFFFAOYSA-N
InChI
InChI=1S/C3BrF7/c4-2(7,8)1(5,6)3(9,10)11

Weigh it out

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

Names and synonyms

7 names
  • Propane, 1-bromo-1,1,2,2,3,3,3-heptafluoro-
  • Propane, 1-bromoheptafluoro-
  • 1-Bromoperfluoropropane
  • Heptafluoropropyl bromide
  • 1-Bromoheptafluoropropane
  • Perfluoropropyl bromide
  • R 217caB1

Work with 1-Bromo-1,1,2,2,3,3,3-heptafluoropropane

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-Bromononafluorobutane375-48-488 % similar 1-Bromoperfluorohexane335-56-882 % similar 1-Bromo-1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoroheptane375-88-282 % similar Perfluorooctyl bromide423-55-282 % similar Nonadecafluorononyl bromide558-96-382 % similar 1,4-Dibromooctafluorobutane335-48-869 % similar 1,8-Dibromoperfluorooctane812-58-865 % similar 1,6-Dibromododecafluorohexane918-22-965 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Bromo-1,1,1,2,3,3,3-heptafluoropropane422-77-5

Elsewhere

PubChem CAS Common Chemistry NIST WebBook