Base information
| Cat. No. | |
| CAS No. | 1391053-79-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H7Br2NO |
| Molecular Weight | 280.945 |
| Exact Mass | 278.889 |
| XLogP3 | 3.3836 |
| Mr | 52.7384 |
| PSA | 35.25 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 18 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | COc1c(Br)ccc(c1N)Br |
