Molecule ID: mol9164
SMILES: CC=C(Cl)C(=O)O
InChI: InChI=1S/C4H5ClO2/c1-2-3(5)4(6)7/h2H,1H3,(H,6,7)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 2.80 | QSARToolbox | 0 » -1 |
| 2.80 | IUPAC digitized pKa | 0 » -1 |
| 3.22 | IUPAC digitized pKa | 0 » -1 |
| 3.22 | OCHEM | 0 » -1 |
| 3.22 | OCHEM | 0 » -1 |
| 3.22 | QSARToolbox | 0 » -1 |
| 3.22 | QSARToolbox | 0 » -1 |
| 3.22 | QSARToolbox | 0 » -1 |