Molecule ID: mol5298
SMILES: CC(N)CCC(=O)O
InChI: InChI=1S/C5H11NO2/c1-4(6)2-3-5(7)8/h4H,2-3,6H2,1H3,(H,7,8)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.97 | IUPAC digitized pKa | 1 » 0 |
| 4.13 | Datawarrior | 1 » 0 |
| 4.13 | OCHEM | 1 » 0 |
| 10.43 | Datawarrior | 0 » -1 |
| 10.43 | OCHEM | 0 » -1 |
| 10.46 | IUPAC digitized pKa | 0 » -1 |