Molecule ID: mol5475
SMILES: N[C@H](C(=O)O)[C@H](O)C(F)(F)F
InChI: InChI=1S/C4H6F3NO3/c5-4(6,7)2(9)1(8)3(10)11/h1-2,9H,8H2,(H,10,11)/t1-,2-/m0/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 1.55 | IUPAC digitized pKa | 1 » 0 |
| 7.78 | IUPAC digitized pKa | 0 » -1 |
| 12.65 | IUPAC digitized pKa | -1 » -2 |