Molecule ID: mol21771
SMILES: O=C(O)CCOc1cccc2ccccc12
InChI: InChI=1S/C13H12O3/c14-13(15)8-9-16-12-7-3-5-10-4-1-2-6-11(10)12/h1-7H,8-9H2,(H,14,15)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.00 | Organic Oxygen Acids and Nitrogen Bases | 0 » -1 |
| 4.00 | OCHEM | 0 » -1 |
| 4.00 | OCHEM | 0 » -1 |
| 4.00 | OCHEM | 0 » -1 |
| 4.00 | OCHEM | 0 » -1 |