chempirical

1,4-Dibromo-2-chloro-1,1,2-trifluorobutane

C4H4Br2ClF3CAS 378-13-2304.33 g/mol

Open in Covalent MOL file
BrFFBrFCl
Alkyl halide

Properties

Molecular formula
C4H4Br2ClF3
Molar mass
304.33 g/mol
Exact mass
301.8320 Da
logP
3.66Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
3

Identifiers

CAS number
378-13-2
SMILES
C(CBr)C(C(F)(F)Br)(F)Cl
InChIKey
RJOGGYLEOPNVJV-UHFFFAOYSA-N
InChI
InChI=1S/C4H4Br2ClF3/c5-2-1-3(7,8)4(6,9)10/h1-2H2

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Names and synonyms

1 names
  • 2-Chloro-1,4-dibromo-1,1,2-trifluorobutane

Work with 1,4-Dibromo-2-chloro-1,1,2-trifluorobutane

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

5-Bromo-4-chloro-4,5,5-trifluoropentan-1-ol222026-50-857 % similar 1,4-Dibromo-1,1,2,2-tetrafluorobutane18599-20-752 % similar 5-Bromo-4-chloro-4,5,5-trifluoropentanoic acid232602-79-850 % similar 3-Bromo-1,1,1-trifluoropropane460-32-238 % similar 1-Bromo-2-chloro-1,1,2,2-tetrafluoroethane354-53-037 % similar 1,2-Dibromo-1-chloro-1,2,2-trifluoroethane354-51-836 % similar 1-Chloro-1,2,2-trifluorocyclobutane661-71-236 % similar Dibromotetrafluoroethane124-73-235 % similar

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

Elsewhere

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