Base information
| Cat. No. | |
| CAS No. | 89001-57-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H7ClO4S |
| Molecular Weight | 234.657 |
| Exact Mass | 233.975 |
| XLogP3 | 2.7015 |
| Mr | 51.4503 |
| PSA | 79.82 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 21 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | OC(=O)c1cc(ccc1C)S(=O)(=O)Cl |
