Molecule ID: mol21720
SMILES: O=C(Nc1ccc(Cl)cc1[N+](=O)[O-])c1cc(Cl)cc(Cl)c1O
InChI: InChI=1S/C13H7Cl3N2O4/c14-6-1-2-10(11(5-6)18(21)22)17-13(20)8-3-7(15)4-9(16)12(8)19/h1-5,19H,(H,17,20)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.11 | Organic Oxygen Acids and Nitrogen Bases | 0 » -1 |
| 4.11 | OCHEM | 0 » -1 |
| 4.11 | OCHEM | 0 » -1 |