Molecule ID: mol21829
SMILES: CN1CCOC(O)(c2ccc(Br)cc2)C1
InChI: InChI=1S/C11H14BrNO2/c1-13-6-7-15-11(14,8-13)9-2-4-10(12)5-3-9/h2-5,14H,6-8H2,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.07 | Organic Oxygen Acids and Nitrogen Bases | 1 » 0 |
| 7.07 | OCHEM | 1 » 0 |
| 7.07 | OCHEM | 1 » 0 |