Molecule ID: mol10823
SMILES: CCOP(=O)(NP(=O)(OCC)OCC)OCC
InChI: InChI=1S/C8H21NO6P2/c1-5-12-16(10,13-6-2)9-17(11,14-7-3)15-8-4/h5-8H2,1-4H3,(H,9,10,11)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.80 | OCHEM | 0 » -1 |
| 4.20 | OCHEM | 0 » -1 |
| 4.45 | QSARToolbox | 0 » -1 |