Structure Info
- Chemspace ID
- CSMB00016268797 (Enamine MADE)
- IUPAC Name
- (2E,4E,6E)-8-bromocycloocta-2,4,6-trien-1-one
- Mol formula
- C8H7BrO
- Mol weight
- 199 Da
- Catalog Number(s)
- BBV-936721332, CSC016268797
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.48
- Heavy atoms count
- 10
- Rotatable bond count
- 0
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.125
- Polar surface area (Å)
- 17
- Hydrogen bond acceptors count
- 1
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB00016268797
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