Base information
| Cat. No. | |
| CAS No. | 1190315-47-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H7IN2O |
| Molecular Weight | 274.058 |
| Exact Mass | 273.96 |
| XLogP3 | 2.1761 |
| Mr | 55.3027 |
| PSA | 37.91 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 20 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | COc1ncc2c(c1)[nH]cc2I |
