Molecule ID: mol33129
SMILES: Cc1ccc([As](=O)(O)O)cc1
InChI: InChI=1S/C7H9AsO3/c1-6-2-4-7(5-3-6)8(9,10)11/h2-5H,1H3,(H2,9,10,11)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.70 | QSARToolbox | 0 » -1 |
| 3.70 | QSARToolbox | 0 » -1 |
| 3.72 | QSARToolbox | 0 » -1 |
| 3.77 | QSARToolbox | 0 » -1 |
| 4.00 | OCHEM | 0 » -1 |
| 8.47 | OCHEM | -1 » -2 |
| 8.68 | QSARToolbox | -1 » -2 |
| 8.68 | QSARToolbox | -1 » -2 |