Molecule ID: mol9798
SMILES: CC(=O)C(=NO)C(C)C
InChI: InChI=1S/C6H11NO2/c1-4(2)6(7-9)5(3)8/h4,9H,1-3H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.50 | IUPAC digitized pKa | 0 » -1 |
| 9.50 | Datawarrior | 0 » -1 |
| 9.50 | OCHEM | 0 » -1 |
| 9.50 | QSARToolbox | 0 » -1 |