Base information
| Cat. No. | |
| CAS No. | 1000343-40-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H8IN3 |
| Molecular Weight | 273.074 |
| Exact Mass | 272.976 |
| XLogP3 | 2.6393 |
| Mr | 58.1811 |
| PSA | 54.7 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 21 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Cc1cc2[nH]nc(c2cc1N)I |
