Base information
| Cat. No. | |
| CAS No. | 21651-04-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H18O4S |
| Molecular Weight | 258.334 |
| Exact Mass | 258.093 |
| XLogP3 | 2.7996 |
| Mr | 65.7168 |
| PSA | 71.98 |
| Sequence | - |
| Atom number | 35 |
| Bond number | 35 |
| Ring number | 1 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | OCC(COS(=O)(=O)c1ccc(cc1)C)(C)C |
