Base information
| Cat. No. | |
| CAS No. | 66416-72-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H5BrIN |
| Molecular Weight | 297.919 |
| Exact Mass | 296.865 |
| XLogP3 | 3.2171 |
| Mr | 51.2634 |
| PSA | 26.02 |
| Sequence | - |
| Atom number | 14 |
| Bond number | 14 |
| Ring number | 1 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Brc1ccc(c(c1)I)N |
