Structure Info
- Chemspace ID
- CSCS00010598610 (Synthesis)
- MFCD
- MFCD24653476
- IUPAC Name
- 4-bromo-1,2,3,3a,4,6a-hexahydropentalen-2-one
- Mol formula
- C8H9BrO
- Mol weight
- 201 Da
- Catalog Number(s)
- BBV-45416775, CSC010598610, FCH1970143
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.62
- Heavy atoms count
- 10
- Rotatable bond count
- 0
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.625
- Polar surface area (Å)
- 17
- Hydrogen bond acceptors count
- 1
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSCS00010598610
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