Base information
| Cat. No. | |
| CAS No. | 1040682-61-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H4BrI2NO |
| Molecular Weight | 439.815 |
| Exact Mass | 438.757 |
| XLogP3 | 3.0619 |
| Mr | 63.863 |
| PSA | 22.12 |
| Sequence | - |
| Atom number | 15 |
| Bond number | 15 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | COc1cc(Br)c(nc1I)I |
