Molecule ID: mol9258
SMILES: O=[N+]([O-])C(F)(F)C(O)(C(F)(F)F)C(F)(F)F
InChI: InChI=1S/C4HF8NO3/c5-2(6,7)1(14,3(8,9)10)4(11,12)13(15)16/h14H
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.90 | IUPAC digitized pKa | 0 » -1 |
| 3.90 | IUPAC digitized pKa | 0 » -1 |
| 3.90 | OCHEM | 0 » -1 |
| 3.90 | AttenGpKa training set | 0 » -1 |
| 3.90 | QSARToolbox | 0 » -1 |
| 3.90 | QSARToolbox | 0 » -1 |
| 3.90 | QSARToolbox | 0 » -1 |