Base information
| Cat. No. | |
| CAS No. | 101-29-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H5I2NO3 |
| Molecular Weight | 404.928 |
| Exact Mass | 404.836 |
| XLogP3 | 1.1421 |
| Mr | 63.9768 |
| PSA | 59.3 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 18 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | OC(=O)Cn1cc(I)c(=O)c(c1)I |
