Molecule ID: mol10756
SMILES: O=C(O)C[S+]([O-])c1ccc(F)cc1
InChI: InChI=1S/C8H7FO3S/c9-6-1-3-7(4-2-6)13(12)5-8(10)11/h1-4H,5H2,(H,10,11)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 2.65 | IUPAC digitized pKa | 0 » -1 |
| 2.65 | AttenGpKa training set | 0 » -1 |
| 4.28 | QSARToolbox | 0 » -1 |