Molecule ID: mol32563
SMILES: CC1CCCCC1C(=O)O
InChI: InChI=1S/C8H14O2/c1-6-4-2-3-5-7(6)8(9)10/h6-7H,2-5H2,1H3,(H,9,10)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.74 | OCHEM | 0 » -1 |
| 4.89 | OCHEM | 0 » -1 |
| 5.04 | QSARToolbox | 0 » -1 |
| 5.74 | QSARToolbox | 0 » -1 |
| 5.74 | QSARToolbox | 0 » -1 |