Molecule ID: mol12154
SMILES: O=C(O)[C@@H]1[C@H](C(=O)O)C12c1ccccc1-c1ccccc12
InChI: InChI=1S/C17H12O4/c18-15(19)13-14(16(20)21)17(13)11-7-3-1-5-9(11)10-6-2-4-8-12(10)17/h1-8,13-14H,(H,18,19)(H,20,21)/t13-,14+
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 2.91 | IUPAC digitized pKa | 0 » -1 |
| 6.66 | IUPAC digitized pKa | -1 » -2 |