Base information
| Cat. No. | |
| CAS No. | 52314-67-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H9Cl3O |
| Molecular Weight | 227.515 |
| Exact Mass | 225.972 |
| XLogP3 | 3.343 |
| Mr | 52.31 |
| PSA | 17.07 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 21 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | ClC(=CC1C(C1(C)C)C(=O)Cl)Cl |
