Molecule ID: mol3408
SMILES: CC(O)(C(=N)N)c1ccccc1
InChI: InChI=1S/C9H12N2O/c1-9(12,8(10)11)7-5-3-2-4-6-7/h2-6,12H,1H3,(H3,10,11)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 10.96 | IUPAC digitized pKa | 1 » 0 |
| 10.96 | OCHEM | 1 » 0 |
| 10.96 | OCHEM | 1 » 0 |
| 12.72 | IUPAC digitized pKa | 0 » -1 |