Molecule ID: mol11832
SMILES: CCC(CC)(C(=O)O)C(CC)(CC)C(=O)OC
InChI: InChI=1S/C13H24O4/c1-6-12(7-2,10(14)15)13(8-3,9-4)11(16)17-5/h6-9H2,1-5H3,(H,14,15)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.34 | IUPAC digitized pKa | 0 » -1 |
| 5.34 | OCHEM | 0 » -1 |
| 5.34 | QSARToolbox | 0 » -1 |
| 5.34 | QSARToolbox | 0 » -1 |
| 5.83 | IUPAC digitized pKa | 0 » -1 |