Structure Info
- Chemspace ID
- CSCS00016014444 (Synthesis)
- IUPAC Name
- (3aS,4R,6aS)-4-methyl-1,3a,4,5,6,6a-hexahydropentalen-1-one
- Mol formula
- C9H12O
- Mol weight
- 136 Da
- Catalog Number(s)
- BBV-77595515, CSC016014444, FCH3920758
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.14
- Heavy atoms count
- 10
- Rotatable bond count
- 0
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.666
- Polar surface area (Å)
- 17
- Hydrogen bond acceptors count
- 1
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSCS00016014444
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