Molecule ID: mol11389
SMILES: NC(CCC(=O)O)c1ccccc1
InChI: InChI=1S/C10H13NO2/c11-9(6-7-10(12)13)8-4-2-1-3-5-8/h1-5,9H,6-7,11H2,(H,12,13)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.18 | IUPAC digitized pKa | 1 » 0 |
| 9.41 | IUPAC digitized pKa | 0 » -1 |