Base information
| Cat. No. | |
| CAS No. | 13739-35-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C10H12O2S |
| Molecular Weight | 196.266 |
| Exact Mass | 196.056 |
| XLogP3 | 2.5618 |
| Mr | 54.5148 |
| PSA | 62.6 |
| Sequence | - |
| Atom number | 25 |
| Bond number | 25 |
| Ring number | 1 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | OC(=O)CCSc1ccc(cc1)C |
