Base information
| Cat. No. | |
| CAS No. | 5535-49-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H9ClS |
| Molecular Weight | 172.675 |
| Exact Mass | 172.011 |
| XLogP3 | 3.0175 |
| Mr | 47.766 |
| PSA | 25.3 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 19 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | ClCCSc1ccccc1 |
