Molecule ID: mol36800
SMILES: O=C(O)CCOCC(CO)(COCCC(=O)O)COCCC(=O)O
InChI: InChI=1S/C14H24O10/c15-7-14(8-22-4-1-11(16)17,9-23-5-2-12(18)19)10-24-6-3-13(20)21/h15H,1-10H2,(H,16,17)(H,18,19)(H,20,21)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.85 | QSARToolbox | 0 » -1 |