Molecule ID: mol13348
SMILES: CC(C)C1C(=O)c2ccccc2C1=O
InChI: InChI=1S/C12H12O2/c1-7(2)10-11(13)8-5-3-4-6-9(8)12(10)14/h3-7,10H,1-2H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.40 | Datawarrior | 0 » -1 |
| 7.40 | QSARToolbox | 0 » -1 |
| 7.40 | OCHEM | 0 » -1 |