Molecule ID: mol10500
SMILES: Cc1cc(Br)c(O)c(=O)c(Br)c1
InChI: InChI=1S/C8H6Br2O2/c1-4-2-5(9)7(11)8(12)6(10)3-4/h2-3H,1H3,(H,11,12)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.35 | IUPAC digitized pKa | 0 » -1 |
| 5.35 | AttenGpKa training set | 0 » -1 |
| 5.59 | OCHEM | 0 » -1 |