Molecule ID: mol775
SMILES: Cc1cc(C)c(O)c(C(C)(C)C)c1
InChI: InChI=1S/C12H18O/c1-8-6-9(2)11(13)10(7-8)12(3,4)5/h6-7,13H,1-5H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 12.04 | IUPAC digitized pKa | 0 » -1 |
| 12.04 | Organic Oxygen Acids and Nitrogen Bases | 0 » -1 |
| 12.04 | OCHEM | 0 » -1 |
| 12.04 | OCHEM | 0 » -1 |
| 12.04 | Hunt | 0 » -1 |
| 12.04 | OCHEM | 0 » -1 |
| 12.04 | OCHEM | 0 » -1 |
| 12.40 | QSARToolbox | 0 » -1 |