Base information
| Cat. No. | |
| CAS No. | 76656-36-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C15H12Na2O11S2 |
| Molecular Weight | 478.359 |
| Exact Mass | 477.962 |
| XLogP3 | 2.3158 |
| Mr | 89.3613 |
| PSA | 207.15 |
| Sequence | - |
| Atom number | 42 |
| Bond number | 41 |
| Ring number | 2 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | COc1cc(O)c(cc1S(=O)(=O)[O-])C(=O)c1cc(c(cc1O)OC)S(=O)(=O)[O-].[Na+].[Na+] |
