Structure Info
- Chemspace ID
- CSMB00020661587 (Enamine MADE)
- IUPAC Name
- 6-bromo-1-hydroxycyclohexa-2,4-dien-1-yl acetate
- Mol formula
- C8H9BrO3
- Mol weight
- 233 Da
- Catalog Number(s)
- BBV-937350158, CSC020661587
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.59
- Heavy atoms count
- 12
- Rotatable bond count
- 2
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.375
- Polar surface area (Å)
- 47
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00020661587
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