Molecule ID: mol31894
SMILES: O=C(O)CCCCCCC[n+]1ccccc1
InChI: InChI=1S/C13H19NO2/c15-13(16)9-5-2-1-3-6-10-14-11-7-4-8-12-14/h4,7-8,11-12H,1-3,5-6,9-10H2/p+1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.50 | OCHEM | 1 » 0 |
| 4.50 | QSARToolbox | 1 » 0 |