Base information
| Cat. No. | |
| CAS No. | 409369-87-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H9IO2 |
| Molecular Weight | 312.103 |
| Exact Mass | 311.965 |
| XLogP3 | 3.231 |
| Mr | 67.9445 |
| PSA | 26.3 |
| Sequence | - |
| Atom number | 24 |
| Bond number | 25 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COC(=O)c1cc2ccccc2cc1I |
