Molecule ID: mol22325
SMILES: O=C(O)CCCC(F)(F)F
InChI: InChI=1S/C5H7F3O2/c6-5(7,8)3-1-2-4(9)10/h1-3H2,(H,9,10)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.49 | OCHEM | 0 » -1 |
| 4.49 | AttenGpKa training set | 0 » -1 |
| 4.50 | OCHEM | 0 » -1 |
| 4.50 | OCHEM | 0 » -1 |