Molecule ID: mol801
SMILES: Oc1ccccc1Cc1ccccc1O
InChI: InChI=1S/C13H12O2/c14-12-7-3-1-5-10(12)9-11-6-2-4-8-13(11)15/h1-8,14-15H,9H2
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.50 | IUPAC digitized pKa | 0 » -1 |
| 7.50 | Hunt | 0 » -1 |
| 7.50 | QSARToolbox | 0 » -1 |
| 7.50 | QSARToolbox | 0 » -1 |
| 7.80 | OCHEM | 0 » -1 |
| 11.30 | OCHEM | -1 » -2 |
| 11.60 | IUPAC digitized pKa | -1 » -2 |
| 11.60 | QSARToolbox | -1 » -2 |