Molecule ID: mol2460
SMILES: Cc1ccc(C)c(O)c1
InChI: InChI=1S/C8H10O/c1-6-3-4-7(2)8(9)5-6/h3-5,9H,1-2H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 10.22 | OCHEM | 0 » -1 |
| 10.22 | OCHEM | 0 » -1 |
| 10.22 | Hunt | 0 » -1 |
| 10.22 | OCHEM | 0 » -1 |
| 10.24 | IUPAC digitized pKa | 0 » -1 |
| 10.32 | AttenGpKa training set | 0 » -1 |
| 10.34 | IUPAC digitized pKa | 0 » -1 |
| 10.36 | Datawarrior | 0 » -1 |
| 10.36 | OCHEM | 0 » -1 |
| 10.40 | QSARToolbox | 0 » -1 |
| 10.40 | OCHEM | 0 » -1 |
| 10.40 | OCHEM | 0 » -1 |
| 10.40 | IUPAC digitized pKa | 0 » -1 |
| 10.41 | OCHEM | 0 » -1 |
| 10.41 | IUPAC digitized pKa | 0 » -1 |
| 10.41 | Organic Oxygen Acids and Nitrogen Bases | 0 » -1 |
| 10.41 | OCHEM | 0 » -1 |
| 10.41 | OCHEM | 0 » -1 |
| 10.46 | IUPAC digitized pKa | 0 » -1 |
| 10.47 | IUPAC digitized pKa | 0 » -1 |
| 10.55 | IUPAC digitized pKa | 0 » -1 |
| 10.62 | IUPAC digitized pKa | 0 » -1 |
| 10.71 | IUPAC digitized pKa | 0 » -1 |