Structure Info
- Chemspace ID
- CSMB00037994750 (Enamine MADE)
- IUPAC Name
- 2-methyl-2-(propane-1-sulfonyl)propanenitrile
- Mol formula
- C7H13NO2S
- Mol weight
- 175 Da
- Catalog Number(s)
- BBV-106059213, CSC037994750, FCH7864178
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 0.72
- Heavy atoms count
- 11
- Rotatable bond count
- 3
- Number of rings
- 0
- Carbon bond saturation, Fsp3
- 0.857
- Polar surface area (Å)
- 58
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB00037994750
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