Base information
| Cat. No. | |
| CAS No. | 1350475-30-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H8IN3O |
| Molecular Weight | 301.084 |
| Exact Mass | 300.971 |
| XLogP3 | 1.8805 |
| Mr | 60.568 |
| PSA | 39.94 |
| Sequence | - |
| Atom number | 22 |
| Bond number | 23 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COc1nccc(c1)n1ccc(n1)I |
