Molecule ID: mol11352
SMILES: O=C(O)CSC(C(=O)O)c1ccccc1
InChI: InChI=1S/C10H10O4S/c11-8(12)6-15-9(10(13)14)7-4-2-1-3-5-7/h1-5,9H,6H2,(H,11,12)(H,13,14)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 2.98 | IUPAC digitized pKa | 0 » -1 |
| 4.65 | IUPAC digitized pKa | -1 » -2 |