Base information
| Cat. No. | |
| CAS No. | 289039-84-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H7ClINO2 |
| Molecular Weight | 311.504 |
| Exact Mass | 310.921 |
| XLogP3 | 2.8946 |
| Mr | 59.8529 |
| PSA | 52.32 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COC(=O)c1cc(Cl)cc(c1N)I |
