Base information
| Cat. No. | |
| CAS No. | 70775-94-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H14O4S |
| Molecular Weight | 218.27 |
| Exact Mass | 218.061 |
| XLogP3 | 2.7572 |
| Mr | 55.5358 |
| PSA | 82.98 |
| Sequence | - |
| Atom number | 28 |
| Bond number | 27 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | Oc1ccccc1.CCCS(=O)(=O)O |
