Molecule ID: mol10379
SMILES: C[N+](C)(C)CCCC(=O)O
InChI: InChI=1S/C7H15NO2/c1-8(2,3)6-4-5-7(9)10/h4-6H2,1-3H3/p+1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.02 | IUPAC digitized pKa | 1 » 0 |
| 4.02 | Datawarrior | 1 » 0 |
| 4.02 | OCHEM | 1 » 0 |
| 4.13 | QSARToolbox | 1 » 0 |
| 4.13 | QSARToolbox | 1 » 0 |
| 4.15 | QSARToolbox | 1 » 0 |