Base information
| Cat. No. | |
| CAS No. | 3172-49-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C19H12O8S |
| Molecular Weight | 400.359 |
| Exact Mass | 400.025 |
| XLogP3 | 3.7063 |
| Mr | 95.689 |
| PSA | 141.9 |
| Sequence | - |
| Atom number | 40 |
| Bond number | 44 |
| Ring number | 5 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Oc1c(O)ccc2c1Oc1c(O)c(O)ccc1C12OS(=O)(=O)c2c1cccc2 |
