Molecule ID: mol11356
SMILES: CC(=O)CC(=O)Nc1ccccc1
InChI: InChI=1S/C10H11NO2/c1-8(12)7-10(13)11-9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H,11,13)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.94 | OCHEM | 0 » -1 |
| 9.94 | Datawarrior | 0 » -1 |
| 10.46 | AttenGpKa training set | 0 » -1 |
| 10.68 | IUPAC digitized pKa | 0 » -1 |