Molecule ID: mol10883
SMILES: COc1ccc(C(=O)O)cc1C
InChI: InChI=1S/C9H10O3/c1-6-5-7(9(10)11)3-4-8(6)12-2/h3-5H,1-2H3,(H,10,11)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.35 | OCHEM | 0 » -1 |
| 4.35 | QSARToolbox | 0 » -1 |
| 4.35 | QSARToolbox | 0 » -1 |
| 4.35 | Datawarrior | 0 » -1 |
| 4.35 | Organic Oxygen Acids and Nitrogen Bases | 0 » -1 |
| 4.35 | OCHEM | 0 » -1 |