Molecule ID: mol10024
SMILES: CCCC(C)(C)C(=O)O
InChI: InChI=1S/C7H14O2/c1-4-5-7(2,3)6(8)9/h4-5H2,1-3H3,(H,8,9)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.97 | QSARToolbox | 0 » -1 |
| 4.97 | IUPAC digitized pKa | 0 » -1 |
| 4.97 | OCHEM | 0 » -1 |
| 4.97 | QSARToolbox | 0 » -1 |
| 4.97 | OCHEM | 0 » -1 |
| 4.97 | OCHEM | 0 » -1 |
| 5.02 | QSARToolbox | 0 » -1 |
| 5.02 | IUPAC digitized pKa | 0 » -1 |
| 5.09 | IUPAC digitized pKa | 0 » -1 |