Base information
| Cat. No. | |
| CAS No. | 178995-71-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H11ClIN3O3 |
| Molecular Weight | 395.581 |
| Exact Mass | 394.953 |
| XLogP3 | 1.33 |
| Mr | 77.0396 |
| PSA | 80.4 |
| Sequence | - |
| Atom number | 30 |
| Bond number | 32 |
| Ring number | 3 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | OC[C@H]1O[C@H](C[C@@H]1O)n1cc(c2c1ncnc2Cl)I |
