Molecule ID: mol9724
SMILES: Cc1ccc(C(=O)O)[nH]1
InChI: InChI=1S/C6H7NO2/c1-4-2-3-5(7-4)6(8)9/h2-3,7H,1H3,(H,8,9)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.88 | IUPAC digitized pKa | 0 » -1 |
| 5.00 | IUPAC digitized pKa | 0 » -1 |
| 5.00 | Datawarrior | 0 » -1 |
| 5.00 | OCHEM | 0 » -1 |