Base information
| Cat. No. | |
| CAS No. | 126353-32-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H6Br2N2O |
| Molecular Weight | 281.933 |
| Exact Mass | 279.885 |
| XLogP3 | 2.0123 |
| Mr | 50.1355 |
| PSA | 42.85 |
| Sequence | - |
| Atom number | 17 |
| Bond number | 16 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | BrCC(=O)c1cnccn1.Br |