Base information
| Cat. No. | |
| CAS No. | 85093-02-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H9BrS |
| Molecular Weight | 253.158 |
| Exact Mass | 251.961 |
| XLogP3 | 4.486 |
| Mr | 62.421 |
| PSA | 28.24 |
| Sequence | - |
| Atom number | 22 |
| Bond number | 23 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Brc1ccc(cc1)c1ccc(s1)C |
