Molecule ID: mol21711
SMILES: O=C(Nc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1O
InChI: InChI=1S/C13H9ClN2O4/c14-8-5-6-10(11(7-8)16(19)20)15-13(18)9-3-1-2-4-12(9)17/h1-7,17H,(H,15,18)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 6.74 | Organic Oxygen Acids and Nitrogen Bases | 0 » -1 |
| 6.74 | OCHEM | 0 » -1 |
| 6.74 | OCHEM | 0 » -1 |