Molecule ID: mol5269
SMILES: NC(CC(F)(F)F)C(=O)O
InChI: InChI=1S/C4H6F3NO2/c5-4(6,7)1-2(8)3(9)10/h2H,1,8H2,(H,9,10)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 1.60 | IUPAC digitized pKa | 1 » 0 |
| 1.60 | OCHEM | 1 » 0 |
| 1.60 | QSARToolbox | 1 » 0 |
| 1.60 | QSARToolbox | 1 » 0 |
| 1.60 | QSARToolbox | 1 » 0 |
| 8.17 | QSARToolbox | 0 » -1 |
| 8.17 | IUPAC digitized pKa | 0 » -1 |
| 8.20 | OCHEM | 0 » -1 |