Base information
| Cat. No. | |
| CAS No. | 1226878-98-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H5ClINO |
| Molecular Weight | 269.467 |
| Exact Mass | 268.91 |
| XLogP3 | 2.3482 |
| Mr | 48.456 |
| PSA | 22.12 |
| Sequence | - |
| Atom number | 15 |
| Bond number | 15 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | COc1cc(Cl)ncc1I |
