Base information
| Cat. No. | |
| CAS No. | 14259-58-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H11IN2O5 |
| Molecular Weight | 354.099 |
| Exact Mass | 353.971 |
| XLogP3 | -1.4092 |
| Mr | 66.0703 |
| PSA | 104.55 |
| Sequence | - |
| Atom number | 28 |
| Bond number | 29 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | IC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1ccc(=O)[nH]c1=O |
