chempirical

4-Bromo-1,1,2-trifluoro-1-butene

C4H4BrF3CAS 10493-44-4188.98 g/mol

Open in Covalent MOL file
FFFBr
AlkeneAlkyl halideVinyl halide

Properties

Molecular formula
C4H4BrF3
Molar mass
188.98 g/mol
Exact mass
187.9448 Da
logP
2.85Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
2

Identifiers

CAS number
10493-44-4
SMILES
FC(F)=C(F)CCBr
InChIKey
GQCQMFYIFUDARF-UHFFFAOYSA-N
InChI
InChI=1S/C4H4BrF3/c5-2-1-3(6)4(7)8/h1-2H2

Weigh it out

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

Names and synonyms

7 names
  • 1-Butene, 4-bromo-1,1,2-trifluoro-
  • 3,4,4-Trifluoro-1-bromo-3-butene
  • 1-Bromo-3,4,4-trifluoro-3-butene
  • 4-Bromo-1,1,2-trifluorobutene-1
  • 4-Bromo-1,1,2-trifluorobutene
  • 3,4,4-Trifluoro-3-butenyl bromide
  • 4-Di-1,1,2-trifluoro-1-butene

Work with 4-Bromo-1,1,2-trifluoro-1-butene

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

6-Bromo-1,1,2-trifluorohex-1-ene126828-29-368 % similar 3-Bromopropanoyl chloride15486-96-131 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook