Molecule ID: mol11497
SMILES: O=C(O)[C@@H]1C[C@]1(C(=O)O)c1ccccc1
InChI: InChI=1S/C11H10O4/c12-9(13)8-6-11(8,10(14)15)7-4-2-1-3-5-7/h1-5,8H,6H2,(H,12,13)(H,14,15)/t8-,11-/m0/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.72 | IUPAC digitized pKa | 0 » -1 |
| 5.14 | IUPAC digitized pKa | -1 » -2 |