chempirical

5-Bromo-3-fluoro-1,2-dihydropyridin-2-one

C5H3BrFNOCAS 156772-63-3191.99 g/mol

Open in Covalent MOL file
ONHBrF
Aryl halide

Properties

Molecular formula
C5H3BrFNO
Molar mass
191.99 g/mol
Exact mass
190.9382 Da
logP
1.28Crippen estimate
Polar surface area
32.9 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

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
156772-63-3
SMILES
C1=C(C(=O)NC=C1Br)F
InChIKey
YBDFQCKEVWUHAP-UHFFFAOYSA-N
InChI
InChI=1S/C5H3BrFNO/c6-3-1-4(7)5(9)8-2-3/h1-2H,(H,8,9)

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Names and synonyms

1 names
  • 5-Bromo-3-fluoro-2-pyridinone

Work with 5-Bromo-3-fluoro-1,2-dihydropyridin-2-one

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-Bromopyridine-2,3-diol34206-49-055 % similar 5-Bromo-3-iodopyridin-2-ol381233-75-655 % similar 5-Bromo-3-chloro-2-hydroxypyridine58236-70-755 % similar 5-Bromo-3-cyano-2-hydroxypyridine405224-22-850 % similar Methyl 5-bromo-2-oxo-1,2-dihydro-3-pyridinecarboxylate120034-05-144 % similar 1,4-Dibromo-3,5-difluorobenzene128259-71-241 % similar 5-Bromo-1,2,3-trifluorobenzene138526-69-941 % similar 3-Fluoro-2-hydroxypyridine1547-29-141 % similar

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

Elsewhere

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