Molecule ID: mol9125
SMILES: C/C=C\C(=O)O
InChI: InChI=1S/C4H6O2/c1-2-3-4(5)6/h2-3H,1H3,(H,5,6)/b3-2-
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.42 | IUPAC digitized pKa | 0 » -1 |
| 4.43 | AttenGpKa training set | 0 » -1 |
| 4.44 | IUPAC digitized pKa | 0 » -1 |
| 4.68 | OCHEM | 0 » -1 |
| 4.70 | IUPAC digitized pKa | 0 » -1 |