Molecule ID: mol14899
SMILES: O=C(O)CC(c1ccccc1)c1ccccc1Cl
InChI: InChI=1S/C15H13ClO2/c16-14-9-5-4-8-12(14)13(10-15(17)18)11-6-2-1-3-7-11/h1-9,13H,10H2,(H,17,18)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.70 | OCHEM | 0 » -1 |
| 4.70 | QSARToolbox | 0 » -1 |
| 4.70 | Datawarrior | 0 » -1 |