Molecule ID: mol11384
SMILES: Cc1cc(O)c(C(C)C)cc1Cl
InChI: InChI=1S/C10H13ClO/c1-6(2)8-5-9(11)7(3)4-10(8)12/h4-6,12H,1-3H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.98 | OCHEM | 0 » -1 |
| 9.98 | QSARToolbox | 0 » -1 |
| 9.98 | QSARToolbox | 0 » -1 |
| 9.98 | IUPAC digitized pKa | 0 » -1 |
| 9.98 | Datawarrior | 0 » -1 |
| 9.98 | Organic Oxygen Acids and Nitrogen Bases | 0 » -1 |
| 9.98 | OCHEM | 0 » -1 |
| 9.98 | OCHEM | 0 » -1 |
| 9.98 | OCHEM | 0 » -1 |
| 9.98 | OCHEM | 0 » -1 |
| 9.98 | OCHEM | 0 » -1 |
| 9.98 | OCHEM | 0 » -1 |
| 9.98 | OCHEM | 0 » -1 |