Base information
| Cat. No. | |
| CAS No. | 70-40-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C15H13I2NO4 |
| Molecular Weight | 525.077 |
| Exact Mass | 524.893 |
| XLogP3 | 4.0484 |
| Mr | 99.4742 |
| PSA | 92.78 |
| Sequence | - |
| Atom number | 35 |
| Bond number | 36 |
| Ring number | 2 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | OC(=O)[C@H](Cc1ccc(c(c1)I)Oc1ccc(c(c1)I)O)N |
