Base information
| Cat. No. | |
| CAS No. | 1311197-82-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H11IN2O |
| Molecular Weight | 278.09 |
| Exact Mass | 277.992 |
| XLogP3 | 2.1868 |
| Mr | 54.405 |
| PSA | 27.05 |
| Sequence | - |
| Atom number | 23 |
| Bond number | 24 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Ic1ccnn1C1CCCCO1 |
