Molecule ID: mol33132
SMILES: O=[N+]([O-])c1ccc([As](=O)(O)O)cc1
InChI: InChI=1S/C6H6AsNO5/c9-7(10,11)5-1-3-6(4-2-5)8(12)13/h1-4H,(H2,9,10,11)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 2.89 | QSARToolbox | 0 » -1 |
| 2.90 | QSARToolbox | 0 » -1 |
| 3.08 | QSARToolbox | 0 » -1 |
| 3.30 | OCHEM | 0 » -1 |
| 7.50 | OCHEM | -1 » -2 |
| 7.80 | QSARToolbox | -1 » -2 |
| 7.80 | QSARToolbox | -1 » -2 |