bis(4-methylphenyl) benzene-1,3-disulfonate
Chemical Structure Depiction of
bis(4-methylphenyl) benzene-1,3-disulfonate
bis(4-methylphenyl) benzene-1,3-disulfonate
Compound characteristics
| Compound ID: | 0091-0002 |
| Compound Name: | bis(4-methylphenyl) benzene-1,3-disulfonate |
| Molecular Weight: | 418.49 |
| Molecular Formula: | C20 H18 O6 S2 |
| Smiles: | Cc1ccc(cc1)OS(c1cccc(c1)S(=O)(=O)Oc1ccc(C)cc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6574 |
| logD: | 4.6574 |
| logSw: | -4.5845 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 71.761 |
| InChI Key: | OZCZQBHRVXLKGD-UHFFFAOYSA-N |