Molecule ID: mol10124
SMILES: O=C(O)c1cccc(S(=O)O)c1
InChI: InChI=1S/C7H6O4S/c8-7(9)5-2-1-3-6(4-5)12(10)11/h1-4H,(H,8,9)(H,10,11)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.95 | IUPAC digitized pKa | -1 » -2 |
| 4.01 | IUPAC digitized pKa | -1 » -2 |
| 4.05 | IUPAC digitized pKa | -1 » -2 |
| 4.09 | IUPAC digitized pKa | -1 » -2 |
| 4.16 | IUPAC digitized pKa | -1 » -2 |
| 4.24 | IUPAC digitized pKa | -1 » -2 |