| Phytochemical Name : (S)-Acetoin |
| PCNDIDOT0251 |
| Pubchem CID : 447765 |
| Molecular formula: C4H8O2 |
| Canonical SMILES : CC(C(=O)C)O |
Synonymes : (S)-Acetoin|(3S)-3-hydroxybutan-2-one|(S)-2-Acetoin|78183-56-9|S,3-HYDROXYBUTAN-2-ONE|(+)-acetoin|2-Butanone, 3-hydroxy-, (3S)-|L-(+)-acetoin|(S)-acetylmethylcarbinol|(S)-3-Hydroxybutan-2-one|(3S)-3-hydroxy-2-butanone|(3S)-3-oxidanylbutan-2-one|CHEBI:15687|1p28|DB02788|C01769|A828564|A934540 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 0.980 |
| Log Po/w (XLOGP3) : -0.300 |
| Log Po/w (WLOGP) : -0.040 |
| Log Po/w (MLOGP) : -0.330 |
| Log Po/w (SILICOS-IT) : -0.040 |
| Consensus Log Po/w : 0.050 |