Molecule ID: mol32979
SMILES: O=C(O)C1CCC1C(=O)O
InChI: InChI=1S/C6H8O4/c7-5(8)3-1-2-4(3)6(9)10/h3-4H,1-2H2,(H,7,8)(H,9,10)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.79 | QSARToolbox | 0 » -1 |
| 4.24 | OCHEM | -1 » -2 |
| 5.20 | OCHEM | -1 » -2 |
| 5.61 | QSARToolbox | -1 » -2 |