Base information
| Cat. No. | |
| CAS No. | 135352-71-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H4IN3O |
| Molecular Weight | 261.02 |
| Exact Mass | 260.94 |
| XLogP3 | 0.8558 |
| Mr | 49.4314 |
| PSA | 61.54 |
| Sequence | - |
| Atom number | 15 |
| Bond number | 16 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Ic1c[nH]c2c1c(=O)[nH]cn2 |
