Molecule ID: mol9170
SMILES: CC(=CCl)C(=O)O
InChI: InChI=1S/C4H5ClO2/c1-3(2-5)4(6)7/h2H,1H3,(H,6,7)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.04 | IUPAC digitized pKa | 0 » -1 |
| 3.05 | Datawarrior | 0 » -1 |
| 3.54 | OCHEM | 0 » -1 |
| 4.03 | Datawarrior | 0 » -1 |
| 4.04 | IUPAC digitized pKa | 0 » -1 |
| 4.04 | OCHEM | 0 » -1 |