Molecule ID: mol21818
SMILES: CN1C2CCC1CC(OC(=O)C(CO)c1ccccc1)C2
InChI: InChI=1S/C17H23NO3/c1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.43 | Organic Oxygen Acids and Nitrogen Bases | 1 » 0 |
| 9.66 | OCHEM | 1 » 0 |