Base information
| Cat. No. | |
| CAS No. | 110545-67-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H7BrO3S |
| Molecular Weight | 251.098 |
| Exact Mass | 249.93 |
| XLogP3 | 2.3058 |
| Mr | 49.7905 |
| PSA | 63.77 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 19 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | COC(=O)c1scc(c1OC)Br |
