Molecule ID: mol3198
SMILES: CC(C)=NO
InChI: InChI=1S/C3H7NO/c1-3(2)4-5/h5H,1-2H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 11.42 | QSARToolbox | 0 » -1 |
| 12.40 | QSARToolbox | 0 » -1 |
| 12.42 | IUPAC digitized pKa | 0 » -1 |
| 12.42 | OCHEM | 0 » -1 |
| 12.42 | AttenGpKa training set | 0 » -1 |
| 12.42 | QSARToolbox | 0 » -1 |
| 12.42 | QSARToolbox | 0 » -1 |
| 12.60 | QSARToolbox | 0 » -1 |
| 16.30 | QSARToolbox | 0 » -1 |