Base information
| Cat. No. | |
| CAS No. | 54413-93-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H7IO3 |
| Molecular Weight | 278.044 |
| Exact Mass | 277.944 |
| XLogP3 | 1.998 |
| Mr | 52.6103 |
| PSA | 46.53 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 19 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COc1ccc(c(c1)C(=O)O)I |
