Structure Info
- Chemspace ID
- CSMB00010133748 (Enamine MADE)
- CAS
- 81945-21-3
- MFCD
- MFCD18208791
- IUPAC Name
- 7-bromo-4-hydroxy-2,3-dihydro-1H-inden-1-one
- Mol formula
- C9H7BrO2
- Mol weight
- 227 Da
- Catalog Number(s)
- 111161, 2688AC, 81945-21-3, A079000784, AA008L2B, ACM81945213, AG-B37023, AG008L53, AM00447, AR008LU3, AS-82229, BBV-40240630, BD239144, CS-0201411, CSC010133748, F19152, F19152-0.25G, F634858, FCH1364523, HY-W134287, JH491596, LAN-B37587, LN02122427, LQT-B37656, OR81902, W164031, Y1338127
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.3
- Heavy atoms count
- 12
- Rotatable bond count
- 0
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.222
- Polar surface area (Å)
- 37
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00010133748
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