Molecule ID: mol9772
SMILES: ON=C1CCCC(=NO)C1=NO
InChI: InChI=1S/C6H9N3O3/c10-7-4-2-1-3-5(8-11)6(4)9-12/h10-12H,1-3H2
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.00 | IUPAC digitized pKa | -2 » -3 |
| 8.12 | OCHEM | -2 » -3 |
| 11.09 | Datawarrior | -1 » -2 |