Molecule ID: mol11510
SMILES: Cc1cc(C)c(C=CC(=O)O)c(O)c1
InChI: InChI=1S/C11H12O3/c1-7-5-8(2)9(10(12)6-7)3-4-11(13)14/h3-6,12H,1-2H3,(H,13,14)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.93 | IUPAC digitized pKa | 0 » -1 |
| 3.93 | OCHEM | 0 » -1 |
| 3.93 | QSARToolbox | 0 » -1 |