Molecule ID: mol8453
SMILES: Nc1cc(F)ccc1C(=O)O
InChI: InChI=1S/C7H6FNO2/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3H,9H2,(H,10,11)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 1.42 | IUPAC digitized pKa | 1 » 0 |
| 1.42 | IUPAC digitized pKa | 1 » 0 |
| 4.60 | IUPAC digitized pKa | 0 » -1 |
| 4.60 | IUPAC digitized pKa | 0 » -1 |