chempirical

Bromo(difluoro)acetyl fluoride

C2BrF3OCAS 38126-07-7176.92 g/mol

Open in Covalent MOL file
OFFBrF
Acyl halideAlkyl halide

Properties

Molecular formula
C2BrF3O
Molar mass
176.92 g/mol
Exact mass
175.9085 Da
logP
1.47Crippen 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
38126-07-7
SMILES
C(=O)(C(F)(F)Br)F
InChIKey
REOFZGQDJKOKFI-UHFFFAOYSA-N
InChI
InChI=1S/C2BrF3O/c3-2(5,6)1(4)7

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Names and synonyms

1 names
  • Bromodifluoroacetyl fluoride

Work with Bromo(difluoro)acetyl fluoride

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

Bromodifluoroacetyl bromide1796-12-948 % similar Bromodifluoroacetamide2169-67-746 % similar 2-Bromo-2,2-difluoroacetic acid354-08-546 % similar Bromodifluoroacetyl chloride3832-48-246 % similar Bromopentafluoroacetone815-23-646 % similar 2,3-Dibromo-1,1,3,3-tetrafluoropropene666-40-040 % similar Ethyl bromodifluoroacetate667-27-637 % similar 2,3,3,3-Tetrafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propanoyl fluoride2062-98-833 % similar

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

Elsewhere

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