Structure Info
- Chemspace ID
- CSMB00020849008 (Enamine MADE)
- MFCD
- MFCD32876052
- IUPAC Name
- 1-(2-bromo-4,6-dimethylphenyl)ethan-1-one
- Mol formula
- C10H11BrO
- Mol weight
- 227 Da
- Catalog Number(s)
- BBV-95810780, CSC020849008, FCH6921056
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.33
- Heavy atoms count
- 12
- Rotatable bond count
- 1
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.3
- Polar surface area (Å)
- 17
- Hydrogen bond acceptors count
- 1
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB00020849008
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