Base information
| Cat. No. | |
| CAS No. | 55119-10-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H6Br3N |
| Molecular Weight | 403.895 |
| Exact Mass | 400.805 |
| XLogP3 | 5.6086 |
| Mr | 78.9047 |
| PSA | 15.79 |
| Sequence | - |
| Atom number | 22 |
| Bond number | 24 |
| Ring number | 3 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Brc1ccc2c(c1)c1cc(Br)cc(c1[nH]2)Br |
