Base information
| Cat. No. | |
| CAS No. | 5857-42-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H8O4S |
| Molecular Weight | 188.201 |
| Exact Mass | 188.014 |
| XLogP3 | 2.0227 |
| Mr | 42.7928 |
| PSA | 71.98 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COc1ccc(cc1)S(=O)(=O)O |
