Molecule ID: mol10442
SMILES: O=C(O)C1=CCCCC1C(=O)O
InChI: InChI=1S/C8H10O4/c9-7(10)5-3-1-2-4-6(5)8(11)12/h3,6H,1-2,4H2,(H,9,10)(H,11,12)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.34 | IUPAC digitized pKa | 0 » -1 |
| 4.34 | OCHEM | -1 » -2 |
| 5.31 | IUPAC digitized pKa | -1 » -2 |
| 5.31 | OCHEM | -1 » -2 |
| 5.31 | OCHEM | -1 » -2 |