Molecule ID: mol1847
SMILES: CCc1cccc(O)c1
InChI: InChI=1S/C8H10O/c1-2-7-4-3-5-8(9)6-7/h3-6,9H,2H2,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.80 | IUPAC digitized pKa | 0 » -1 |
| 9.85 | IUPAC digitized pKa | 0 » -1 |
| 9.90 | IUPAC digitized pKa | 0 » -1 |
| 9.90 | QSARToolbox | 0 » -1 |
| 9.90 | Organic Oxygen Acids and Nitrogen Bases | 0 » -1 |
| 9.90 | OCHEM | 0 » -1 |
| 9.90 | OCHEM | 0 » -1 |
| 9.90 | OCHEM | 0 » -1 |
| 9.90 | Hunt | 0 » -1 |
| 9.90 | OCHEM | 0 » -1 |
| 9.90 | OCHEM | 0 » -1 |
| 9.90 | OCHEM | 0 » -1 |
| 9.95 | IUPAC digitized pKa | 0 » -1 |
| 10.01 | IUPAC digitized pKa | 0 » -1 |
| 10.07 | IUPAC digitized pKa | 0 » -1 |
| 10.07 | OCHEM | 0 » -1 |
| 10.07 | OCHEM | 0 » -1 |
| 10.07 | OCHEM | 0 » -1 |
| 10.14 | IUPAC digitized pKa | 0 » -1 |
| 10.21 | IUPAC digitized pKa | 0 » -1 |
| 10.29 | IUPAC digitized pKa | 0 » -1 |
| 10.37 | IUPAC digitized pKa | 0 » -1 |