Molecule ID: mol11797
SMILES: O=C(O)CC[As](CCC(=O)O)c1ccc(Cl)cc1
InChI: InChI=1S/C12H14AsClO4/c14-10-3-1-9(2-4-10)13(7-5-11(15)16)8-6-12(17)18/h1-4H,5-8H2,(H,15,16)(H,17,18)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.17 | IUPAC digitized pKa | -1 » -2 |
| 5.08 | IUPAC digitized pKa | 0 » -1 |