Structure Info
- Chemspace ID
- CSCS00010898387 (Synthesis)
- MFCD
- MFCD26528296
- IUPAC Name
- 2-chloro-2-(ethanesulfonyl)butanenitrile
- Mol formula
- C6H10ClNO2S
- Mol weight
- 196 Da
- Catalog Number(s)
- BBV-54503288, CSC010898387, FCH2433111, LN00310051, PBMR195724
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.38
- Heavy atoms count
- 11
- Rotatable bond count
- 3
- Number of rings
- 0
- Carbon bond saturation, Fsp3
- 0.833
- Polar surface area (Å)
- 58
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSCS00010898387
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