Molecule ID: mol21774
SMILES: C=CCOc1ccc(CC(=O)O)cc1Cl
InChI: InChI=1S/C11H11ClO3/c1-2-5-15-10-4-3-8(6-9(10)12)7-11(13)14/h2-4,6H,1,5,7H2,(H,13,14)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.29 | Organic Oxygen Acids and Nitrogen Bases | 0 » -1 |
| 4.29 | OCHEM | 0 » -1 |
| 4.29 | OCHEM | 0 » -1 |
| 4.29 | OCHEM | 0 » -1 |
| 4.29 | OCHEM | 0 » -1 |