Base information
| Cat. No. | |
| CAS No. | 1227581-53-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H5BrF3NO2 |
| Molecular Weight | 284.03 |
| Exact Mass | 282.946 |
| XLogP3 | 2.6495 |
| Mr | 48.2185 |
| PSA | 39.19 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | COC(=O)c1ccc(nc1C(F)(F)F)Br |
