Structure Info
- Chemspace ID
- CSMB20451642200 (Enamine MADE)
- IUPAC Name
- 5-tert-butyl-6-hydroxy-2,3-dihydro-1H-inden-1-one
- Mol formula
- C13H16O2
- Mol weight
- 204 Da
- Catalog Number(s)
- BBV-1299505766
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.08
- Heavy atoms count
- 15
- Rotatable bond count
- 1
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.461
- Polar surface area (Å)
- 37
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB20451642200
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