Molecule ID: mol677
SMILES: OC(C(F)(F)F)C(F)(F)F
InChI: InChI=1S/C3H2F6O/c4-2(5,6)1(10)3(7,8)9/h1,10H
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.20 | QSARToolbox | 0 » -1 |
| 9.20 | QSARToolbox | 0 » -1 |
| 9.20 | QSARToolbox | 0 » -1 |
| 9.27 | QSARToolbox | 0 » -1 |
| 9.30 | IUPAC digitized pKa | 0 » -1 |
| 9.30 | IUPAC digitized pKa | 0 » -1 |
| 9.30 | OCHEM | 0 » -1 |
| 9.30 | OCHEM | 0 » -1 |
| 9.30 | OCHEM | 0 » -1 |
| 9.30 | Hunt | 0 » -1 |
| 9.30 | OCHEM | 0 » -1 |
| 9.30 | AttenGpKa training set | 0 » -1 |
| 9.30 | QSARToolbox | 0 » -1 |
| 9.30 | QSARToolbox | 0 » -1 |
| 9.30 | QSARToolbox | 0 » -1 |
| 9.42 | OCHEM | 0 » -1 |
| 9.42 | OCHEM | 0 » -1 |