Molecule ID: mol11519
SMILES: Cc1cc(C)c(C)c(C(=O)O)c1C
InChI: InChI=1S/C11H14O2/c1-6-5-7(2)9(4)10(8(6)3)11(12)13/h5H,1-4H3,(H,12,13)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.31 | IUPAC digitized pKa | 0 » -1 |
| 3.37 | IUPAC digitized pKa | 0 » -1 |
| 3.41 | OCHEM | 0 » -1 |
| 3.41 | OCHEM | 0 » -1 |
| 3.42 | QSARToolbox | 0 » -1 |
| 3.42 | IUPAC digitized pKa | 0 » -1 |
| 3.42 | OCHEM | 0 » -1 |
| 3.42 | Organic Oxygen Acids and Nitrogen Bases | 0 » -1 |
| 3.43 | Datawarrior | 0 » -1 |
| 3.43 | QSARToolbox | 0 » -1 |
| 3.43 | QSARToolbox | 0 » -1 |
| 3.43 | OCHEM | 0 » -1 |
| 3.45 | IUPAC digitized pKa | 0 » -1 |
| 3.49 | IUPAC digitized pKa | 0 » -1 |
| 3.50 | IUPAC digitized pKa | 0 » -1 |
| 3.52 | QSARToolbox | 0 » -1 |