Molecule ID: mol35145
SMILES: CCC(COCCC(=O)O)(COCCC(=O)O)COCCC(=O)O
InChI: InChI=1S/C15H26O9/c1-2-15(9-22-6-3-12(16)17,10-23-7-4-13(18)19)11-24-8-5-14(20)21/h2-11H2,1H3,(H,16,17)(H,18,19)(H,20,21)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.14 | QSARToolbox | 0 » -1 |