Molecule ID: mol34184
SMILES: O=C(O)c1cccc(P(=O)(O)O)n1
InChI: InChI=1S/C6H6NO5P/c8-6(9)4-2-1-3-5(7-4)13(10,11)12/h1-3H,(H,8,9)(H2,10,11,12)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 1.00 | QSARToolbox | 0 » -1 |
| 1.00 | QSARToolbox | 0 » -1 |
| 7.01 | QSARToolbox | -2 » -3 |