Base information
| Cat. No. | |
| CAS No. | 68236-26-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H6BrNOS |
| Molecular Weight | 220.087 |
| Exact Mass | 218.935 |
| XLogP3 | 2.542 |
| Mr | 46.3317 |
| PSA | 57.34 |
| Sequence | - |
| Atom number | 16 |
| Bond number | 16 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | CC(=O)Nc1ccc(s1)Br |
