Molecule ID: mol10951
SMILES: O=C(O)C=C(Cl)c1ccccc1
InChI: InChI=1S/C9H7ClO2/c10-8(6-9(11)12)7-4-2-1-3-5-7/h1-6H,(H,11,12)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.55 | QSARToolbox | 0 » -1 |
| 3.55 | QSARToolbox | 0 » -1 |
| 3.55 | IUPAC digitized pKa | 0 » -1 |
| 3.56 | OCHEM | 0 » -1 |
| 3.57 | QSARToolbox | 0 » -1 |
| 3.57 | IUPAC digitized pKa | 0 » -1 |