Molecule ID: mol8993
SMILES: OCC(O)CO
InChI: InChI=1S/C3H8O3/c4-1-3(6)2-5/h3-6H,1-2H2
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 14.10 | QSARToolbox | 0 » -1 |
| 14.10 | QSARToolbox | 0 » -1 |
| 14.15 | OCHEM | 0 » -1 |
| 14.15 | OCHEM | 0 » -1 |
| 14.40 | IUPAC digitized pKa | 0 » -1 |
| 14.40 | AttenGpKa training set | 0 » -1 |
| 14.70 | OCHEM | 0 » -1 |
| 14.70 | OCHEM | 0 » -1 |