Base information
| Cat. No. | |
| CAS No. | 42498-44-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H9ClO |
| Molecular Weight | 216.663 |
| Exact Mass | 216.034 |
| XLogP3 | 3.7326 |
| Mr | 62.0615 |
| PSA | 17.07 |
| Sequence | - |
| Atom number | 24 |
| Bond number | 25 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | ClC(=O)c1cccc(c1)c1ccccc1 |
