Molecule ID: mol2010
SMILES: Oc1cc(Cl)ccc1Cl
InChI: InChI=1S/C6H4Cl2O/c7-4-1-2-5(8)6(9)3-4/h1-3,9H
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.51 | IUPAC digitized pKa | 0 » -1 |
| 7.51 | Organic Oxygen Acids and Nitrogen Bases | 0 » -1 |
| 7.51 | OCHEM | 0 » -1 |
| 7.51 | OCHEM | 0 » -1 |
| 7.51 | OCHEM | 0 » -1 |
| 7.51 | Hunt | 0 » -1 |
| 7.51 | OCHEM | 0 » -1 |
| 7.51 | OCHEM | 0 » -1 |
| 7.51 | OCHEM | 0 » -1 |
| 7.51 | AttenGpKa training set | 0 » -1 |
| 7.51 | QSARToolbox | 0 » -1 |
| 7.51 | QSARToolbox | 0 » -1 |