Base information
| Cat. No. | |
| CAS No. | 688798-62-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H12BrNO2S |
| Molecular Weight | 278.166 |
| Exact Mass | 276.977 |
| XLogP3 | 3.1703 |
| Mr | 59.746 |
| PSA | 45.76 |
| Sequence | - |
| Atom number | 26 |
| Bond number | 26 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | CCN(S(=O)(=O)c1ccccc1Br)C |
