Structure Info
- Chemspace ID
- CSMB00000117329 (Enamine MADE)
- MFCD
- MFCD07777222
- IUPAC Name
- 1-[(trifluoromethyl)sulfanyl]propan-2-one
- Mol formula
- C4H5F3OS
- Mol weight
- 158 Da
- Catalog Number(s)
- BBV-38361109, CSC000117329, FCH922851, JH684438
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.06
- Heavy atoms count
- 9
- Rotatable bond count
- 3
- Number of rings
- 0
- Carbon bond saturation, Fsp3
- 0.75
- Polar surface area (Å)
- 17
- Hydrogen bond acceptors count
- 1
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB00000117329
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