Structure Info
- Chemspace ID
- CSMB06358833173 (Enamine MADE)
- IUPAC Name
- 2-difluoromethanesulfonyl-3-methylbutanenitrile
- Mol formula
- C6H9F2NO2S
- Mol weight
- 197 Da
- Catalog Number(s)
- BBV-564347956, PV-009041457889, m_7_13138042_13974124, m_7____13138042____13974124
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.75
- Heavy atoms count
- 12
- 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
- CSMB06358833173
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