Structure Info
- Chemspace ID
- CSMB00113626623 (Enamine MADE)
- MFCD
- MFCD32780817
- IUPAC Name
- 2-methanesulfonylbut-3-enenitrile
- Mol formula
- C5H7NO2S
- Mol weight
- 145 Da
- Catalog Number(s)
- BBV-148591435, CSC113626623
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- -0.37
- Heavy atoms count
- 9
- Rotatable bond count
- 2
- Number of rings
- 0
- Carbon bond saturation, Fsp3
- 0.4
- Polar surface area (Å)
- 58
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB00113626623
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