Base information
| Cat. No. | |
| CAS No. | 110661-59-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H9ClO3S |
| Molecular Weight | 220.673 |
| Exact Mass | 219.996 |
| XLogP3 | 2.8446 |
| Mr | 51.66 |
| PSA | 51.75 |
| Sequence | - |
| Atom number | 22 |
| Bond number | 22 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | COc1ccc(cc1)CS(=O)(=O)Cl |
