Molecule ID: mol11280
SMILES: Oc1cc(I)cc2ccccc12
InChI: InChI=1S/C10H7IO/c11-8-5-7-3-1-2-4-9(7)10(12)6-8/h1-6,12H
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.36 | QSARToolbox | 0 » -1 |
| 8.36 | QSARToolbox | 0 » -1 |
| 8.36 | IUPAC digitized pKa | 0 » -1 |
| 8.36 | OCHEM | 0 » -1 |