Molecule ID: mol32449
SMILES: CC1CCCC(C(=O)O)C1
InChI: InChI=1S/C8H14O2/c1-6-3-2-4-7(5-6)8(9)10/h6-7H,2-5H2,1H3,(H,9,10)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.57 | QSARToolbox | 0 » -1 |
| 4.80 | OCHEM | 0 » -1 |
| 4.88 | OCHEM | 0 » -1 |
| 5.20 | QSARToolbox | 0 » -1 |
| 5.20 | QSARToolbox | 0 » -1 |