Structure Info
- Chemspace ID
- CSCS00010653120 (Synthesis)
- MFCD
- MFCD24708131
- IUPAC Name
- 2-methyl-1,2,3,4,5,6-hexahydropentalen-1-one
- Mol formula
- C9H12O
- Mol weight
- 136 Da
- Catalog Number(s)
- BBV-45475748, CSC010653120, FCH2028427
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.2
- 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
- CSCS00010653120
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