Molecule ID: mol34268
SMILES: CC(C)(C)C(=O)Oc1ccccc1C(=O)O
InChI: InChI=1S/C12H14O4/c1-12(2,3)11(15)16-9-7-5-4-6-8(9)10(13)14/h4-7H,1-3H3,(H,13,14)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.87 | QSARToolbox | 0 » -1 |
| 3.87 | QSARToolbox | 0 » -1 |