Structure Info
- Chemspace ID
- CSMB03550603474 (Enamine MADE)
- IUPAC Name
- 2-(3,3-dimethylbutanesulfonyl)propanenitrile
- Mol formula
- C9H17NO2S
- Mol weight
- 203 Da
- Catalog Number(s)
- BBV-392146740
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.32
- Heavy atoms count
- 13
- Rotatable bond count
- 4
- Number of rings
- 0
- Carbon bond saturation, Fsp3
- 0.888
- Polar surface area (Å)
- 58
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB03550603474
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