Structure Info
- Chemspace ID
- CSCS00134911263 (Synthesis)
- IUPAC Name
- (2S)-1,1-dioxo-1λ⁶-thiane-2-carbonitrile
- Mol formula
- C6H9NO2S
- Mol weight
- 159 Da
- Catalog Number(s)
- BBV-128222966, CSC134911263, FCH19633280
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- -0.09
- Heavy atoms count
- 10
- Rotatable bond count
- 0
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.833
- Polar surface area (Å)
- 58
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSCS00134911263
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