Molecule ID: mol3424
SMILES: CC(N)C(O)c1ccccc1
InChI: InChI=1S/C9H13NO/c1-7(10)9(11)8-5-3-2-4-6-8/h2-7,9,11H,10H2,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.81 | OCHEM | 1 » 0 |
| 9.44 | QSARToolbox | 1 » 0 |
| 9.44 | IUPAC digitized pKa | 1 » 0 |
| 9.44 | Organic Oxygen Acids and Nitrogen Bases | 1 » 0 |
| 9.44 | OCHEM | 1 » 0 |