Structure Info
- Chemspace ID
- CSMB00010105186 (Enamine MADE)
- MFCD
- MFCD19352446
- IUPAC Name
- 1-(2-bromophenyl)propane-1,2-dione
- Mol formula
- C9H7BrO2
- Mol weight
- 227 Da
- Catalog Number(s)
- BBV-40231765, CSC010105186, FCH1355658, IMED3241584308
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.59
- Heavy atoms count
- 12
- Rotatable bond count
- 2
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.111
- Polar surface area (Å)
- 34
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB00010105186
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