Molecule ID: mol9052
SMILES: COCC([N+](=O)[O-])[N+](=O)[O-]
InChI: InChI=1S/C3H6N2O5/c1-10-2-3(4(6)7)5(8)9/h3H,2H2,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.48 | IUPAC digitized pKa | 0 » -1 |
| 3.48 | AttenGpKa training set | 0 » -1 |
| 3.56 | IUPAC digitized pKa | 0 » -1 |