Molecule ID: mol10956
SMILES: O=C(O)c1ccc(C=C[N+](=O)[O-])cc1
InChI: InChI=1S/C9H7NO4/c11-9(12)8-3-1-7(2-4-8)5-6-10(13)14/h1-6H,(H,11,12)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.94 | IUPAC digitized pKa | 0 » -1 |
| 3.94 | OCHEM | 0 » -1 |
| 3.94 | QSARToolbox | 0 » -1 |
| 3.94 | QSARToolbox | 0 » -1 |
| 3.94 | OCHEM | 0 » -1 |