Base information
| Cat. No. | |
| CAS No. | 4786-72-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H6BrClN2 |
| Molecular Weight | 221.482 |
| Exact Mass | 219.94 |
| XLogP3 | 2.5093 |
| Mr | 44.674 |
| PSA | 25.78 |
| Sequence | - |
| Atom number | 16 |
| Bond number | 16 |
| Ring number | 1 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Clc1nc(C)c(c(n1)C)Br |
