Molecule ID: mol9204
SMILES: CC(C(O)C(=O)O)([N+](=O)[O-])[N+](=O)[O-]
InChI: InChI=1S/C4H6N2O7/c1-4(5(10)11,6(12)13)2(7)3(8)9/h2,7H,1H3,(H,8,9)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 2.37 | QSARToolbox | 0 » -1 |
| 2.37 | QSARToolbox | 0 » -1 |
| 2.37 | IUPAC digitized pKa | 0 » -1 |
| 2.37 | OCHEM | 0 » -1 |
| 5.42 | IUPAC digitized pKa | -1 » -2 |
| 5.42 | QSARToolbox | 0 » -1 |