Base information
| Cat. No. | |
| CAS No. | 569667-89-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H6Br2ClNO |
| Molecular Weight | 315.39 |
| Exact Mass | 312.85 |
| XLogP3 | 3.2707 |
| Mr | 57.3505 |
| PSA | 29.96 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 17 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | BrCC(=O)c1ccnc(c1)Cl.Br |