Structure Info
- Chemspace ID
- CSMB00102603690 (Enamine MADE)
- IUPAC Name
- 3-methyl-1,4-dioxepan-2-one
- Mol formula
- C6H10O3
- Mol weight
- 130 Da
- Catalog Number(s)
- BBV-940497137, CSC102603690, JH421715
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 0.21
- Heavy atoms count
- 9
- Rotatable bond count
- 0
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.833
- Polar surface area (Å)
- 36
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB00102603690
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