Molecule ID: mol9076
SMILES: CC(C)P(=O)(O)O
InChI: InChI=1S/C3H9O3P/c1-3(2)7(4,5)6/h3H,1-2H3,(H2,4,5,6)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 2.55 | QSARToolbox | 0 » -1 |
| 2.55 | IUPAC digitized pKa | 0 » -1 |
| 2.55 | AttenGpKa training set | 0 » -1 |
| 2.66 | OCHEM | 0 » -1 |
| 2.66 | QSARToolbox | 0 » -1 |
| 2.66 | QSARToolbox | 0 » -1 |
| 2.66 | QSARToolbox | 0 » -1 |
| 7.75 | IUPAC digitized pKa | -1 » -2 |
| 7.75 | QSARToolbox | -1 » -2 |
| 7.75 | AttenGpKa training set | -1 » -2 |
| 8.44 | QSARToolbox | -1 » -2 |
| 8.44 | QSARToolbox | -1 » -2 |
| 8.44 | OCHEM | -1 » -2 |