Base information
| Cat. No. | |
| CAS No. | 76318-50-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C10H11I2NO3 |
| Molecular Weight | 447.008 |
| Exact Mass | 446.883 |
| XLogP3 | 2.3445 |
| Mr | 77.2784 |
| PSA | 72.55 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 27 |
| Ring number | 1 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | COC(=O)[C@H](Cc1cc(I)c(c(c1)I)O)N |
