Molecule ID: mol14048
SMILES: CC(C)(C)P(=O)(O)C(C)(C)C
InChI: InChI=1S/C8H19O2P/c1-7(2,3)11(9,10)8(4,5)6/h1-6H3,(H,9,10)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.20 | AttenGpKa training set | 0 » -1 |
| 4.24 | QSARToolbox | 0 » -1 |
| 4.24 | QSARToolbox | 0 » -1 |
| 4.24 | OCHEM | 0 » -1 |
| 4.24 | Datawarrior | 0 » -1 |