Base information
| Cat. No. | |
| CAS No. | 1245647-65-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H5IN4 |
| Molecular Weight | 260.035 |
| Exact Mass | 259.956 |
| XLogP3 | 1.4973 |
| Mr | 50.1084 |
| PSA | 56.21 |
| Sequence | - |
| Atom number | 16 |
| Bond number | 17 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Ic1ccc2n(c1)nc(n2)N |
