Base information
| Cat. No. | |
| CAS No. | 3914-31-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C15H11I3O4 |
| Molecular Weight | 635.959 |
| Exact Mass | 635.779 |
| XLogP3 | 5.0155 |
| Mr | 109.484 |
| PSA | 66.76 |
| Sequence | - |
| Atom number | 33 |
| Bond number | 34 |
| Ring number | 2 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | OC(=O)CCc1ccc(c(c1)I)Oc1cc(I)c(c(c1)I)O |
