chempirical

Bromodifluoroacetyl bromide

C2Br2F2OCAS 1796-12-9237.83 g/mol

Open in Covalent MOL file
OFFBrBr
Acyl halideAlkyl halide

Properties

Molecular formula
C2Br2F2O
Molar mass
237.83 g/mol
Exact mass
235.8284 Da
logP
1.90Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
1796-12-9
SMILES
C(=O)(C(F)(F)Br)Br
InChIKey
FRTUTWXODRBCOL-UHFFFAOYSA-N
InChI
InChI=1S/C2Br2F2O/c3-1(7)2(4,5)6

Weigh it out

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

Work with Bromodifluoroacetyl bromide

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

Bromo(difluoro)acetyl fluoride38126-07-748 % similar Bromodifluoroacetamide2169-67-746 % similar 2-Bromo-2,2-difluoroacetic acid354-08-546 % similar Bromodifluoroacetyl chloride3832-48-246 % similar Bromopentafluoroacetone815-23-646 % similar 2-Bromoisobutyryl bromide20769-85-143 % similar 2,3-Dibromo-1,1,3,3-tetrafluoropropene666-40-040 % similar Ethyl bromodifluoroacetate667-27-637 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook