Molecule ID: mol11270
SMILES: CCC(C)(OC(C)(CC)C(=O)O)C(=O)O
InChI: InChI=1S/C10H18O5/c1-5-9(3,7(11)12)15-10(4,6-2)8(13)14/h5-6H2,1-4H3,(H,11,12)(H,13,14)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.70 | IUPAC digitized pKa | 0 » -1 |
| 5.41 | IUPAC digitized pKa | -1 » -2 |