Molecule ID: mol10869
SMILES: Cc1cc(C)cc(C(=O)O)c1
InChI: InChI=1S/C9H10O2/c1-6-3-7(2)5-8(4-6)9(10)11/h3-5H,1-2H3,(H,10,11)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.30 | IUPAC digitized pKa | 0 » -1 |
| 4.30 | IUPAC digitized pKa | 0 » -1 |
| 4.30 | IUPAC digitized pKa | 0 » -1 |
| 4.30 | Datawarrior | 0 » -1 |
| 4.30 | Organic Oxygen Acids and Nitrogen Bases | 0 » -1 |
| 4.30 | OCHEM | 0 » -1 |
| 4.30 | OCHEM | 0 » -1 |
| 4.30 | QSARToolbox | 0 » -1 |
| 4.30 | QSARToolbox | 0 » -1 |
| 4.30 | QSARToolbox | 0 » -1 |
| 4.30 | OCHEM | 0 » -1 |
| 4.30 | IUPAC digitized pKa | 0 » -1 |
| 4.31 | IUPAC digitized pKa | 0 » -1 |
| 4.31 | IUPAC digitized pKa | 0 » -1 |
| 4.32 | QSARToolbox | 0 » -1 |
| 4.34 | AttenGpKa training set | 0 » -1 |
| 4.35 | OCHEM | 0 » -1 |
| 4.39 | QSARToolbox | 0 » -1 |
| 4.39 | IUPAC digitized pKa | 0 » -1 |