Base information
| Cat. No. | |
| CAS No. | 211235-87-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H6O4S |
| Molecular Weight | 198.196 |
| Exact Mass | 197.999 |
| XLogP3 | 1.1443 |
| Mr | 45.964 |
| PSA | 80.84 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 20 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | O=Cc1sc(c2c1OCCO2)C=O |