Base information
| Cat. No. | |
| CAS No. | 120317-69-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C4H8IN3 |
| Molecular Weight | 225.031 |
| Exact Mass | 224.976 |
| XLogP3 | -3.7514 |
| Mr | 41.1 |
| PSA | 21.7 |
| Sequence | - |
| Atom number | 16 |
| Bond number | 15 |
| Ring number | 1 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Cn1cn[n+](c1)C.[I-] |
