Molecule ID: mol9473
SMILES: O=c1cc(C(F)(F)F)[nH]c(=O)[nH]1
InChI: InChI=1S/C5H3F3N2O2/c6-5(7,8)2-1-3(11)10-4(12)9-2/h1H,(H2,9,10,11,12)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.70 | IUPAC digitized pKa | 0 » -1 |
| 13.00 | IUPAC digitized pKa | -1 » -2 |