Molecule ID: mol31682
SMILES: O=C(O)C1(C(=O)O)CCC1
InChI: InChI=1S/C6H8O4/c7-4(8)6(5(9)10)2-1-3-6/h1-3H2,(H,7,8)(H,9,10)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.13 | OCHEM | 0 » -1 |
| 3.13 | OCHEM | 0 » -1 |
| 3.16 | QSARToolbox | 0 » -1 |
| 3.16 | QSARToolbox | 0 » -1 |
| 3.43 | OCHEM | 0 » -1 |
| 5.60 | OCHEM | -1 » -2 |