Base information
| Cat. No. | |
| CAS No. | 1093117-21-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H11BrS |
| Molecular Weight | 279.195 |
| Exact Mass | 277.976 |
| XLogP3 | 4.7327 |
| Mr | 69.843 |
| PSA | 25.3 |
| Sequence | - |
| Atom number | 26 |
| Bond number | 27 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | BrCc1ccc(cc1)Sc1ccccc1 |
