Molecule ID: mol8927
SMILES: O=P(O)(O)C(Cl)Cl
InChI: InChI=1S/CH3Cl2O3P/c2-1(3)7(4,5)6/h1H,(H2,4,5,6)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 1.14 | QSARToolbox | 0 » -1 |
| 1.14 | QSARToolbox | 0 » -1 |
| 1.14 | QSARToolbox | 0 » -1 |
| 1.14 | QSARToolbox | 0 » -1 |
| 1.14 | IUPAC digitized pKa | 0 » -1 |
| 1.14 | OCHEM | 0 » -1 |
| 1.14 | AttenGpKa training set | 0 » -1 |
| 4.97 | QSARToolbox | -1 » -2 |
| 4.97 | QSARToolbox | -1 » -2 |
| 4.97 | IUPAC digitized pKa | -1 » -2 |
| 5.58 | IUPAC digitized pKa | -1 » -2 |
| 5.61 | OCHEM | -1 » -2 |
| 5.61 | AttenGpKa training set | -1 » -2 |
| 5.61 | QSARToolbox | -1 » -2 |
| 5.61 | QSARToolbox | -1 » -2 |
| 5.61 | QSARToolbox | -1 » -2 |