Base information
| Cat. No. | |
| CAS No. | 117-96-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H9I3N2O4 |
| Molecular Weight | 613.914 |
| Exact Mass | 613.77 |
| XLogP3 | 3.2614 |
| Mr | 100.178 |
| PSA | 95.5 |
| Sequence | - |
| Atom number | 29 |
| Bond number | 29 |
| Ring number | 1 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | CC(=O)Nc1c(I)c(NC(=O)C)c(c(c1I)C(=O)O)I |
