Molecule ID: mol13922
SMILES: N#CC(Cc1ccccc1)C(=O)O
InChI: InChI=1S/C10H9NO2/c11-7-9(10(12)13)6-8-4-2-1-3-5-8/h1-5,9H,6H2,(H,12,13)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 2.24 | Datawarrior | 0 » -1 |
| 2.24 | OCHEM | 0 » -1 |
| 2.24 | QSARToolbox | 0 » -1 |