Molecule ID: mol34121
SMILES: O=C(O)CCCP(=O)(c1ccccc1)c1ccccc1
InChI: InChI=1S/C16H17O3P/c17-16(18)12-7-13-20(19,14-8-3-1-4-9-14)15-10-5-2-6-11-15/h1-6,8-11H,7,12-13H2,(H,17,18)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.81 | QSARToolbox | 0 » -1 |
| 5.81 | QSARToolbox | 0 » -1 |