Base information
| Cat. No. | |
| CAS No. | 1309788-50-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H13IN2 |
| Molecular Weight | 276.117 |
| Exact Mass | 276.012 |
| XLogP3 | 2.5292 |
| Mr | 58.0907 |
| PSA | 28.68 |
| Sequence | - |
| Atom number | 25 |
| Bond number | 26 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Ic1n[nH]c2c1CCC(C2)(C)C |
