Molecule ID: mol8446
SMILES: COC(=O)[C@H](C)N
InChI: InChI=1S/C4H9NO2/c1-3(5)4(6)7-2/h3H,5H2,1-2H3/t3-/m0/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.09 | IUPAC digitized pKa | 1 » 0 |
| 7.42 | IUPAC digitized pKa | 1 » 0 |
| 7.74 | IUPAC digitized pKa | 1 » 0 |
| 7.86 | IUPAC digitized pKa | 1 » 0 |
| 7.96 | IUPAC digitized pKa | 1 » 0 |