Base information
| Cat. No. | |
| CAS No. | 1057076-51-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H9ClINO2 |
| Molecular Weight | 325.531 |
| Exact Mass | 324.937 |
| XLogP3 | 3.2847 |
| Mr | 64.6599 |
| PSA | 52.32 |
| Sequence | - |
| Atom number | 23 |
| Bond number | 23 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | CCOC(=O)c1cc(I)c(cc1Cl)N |
