Base information
| Cat. No. | |
| CAS No. | 80789-69-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H13ClO2 |
| Molecular Weight | 224.683 |
| Exact Mass | 224.06 |
| XLogP3 | 3.2364 |
| Mr | 59.9938 |
| PSA | 37.3 |
| Sequence | - |
| Atom number | 28 |
| Bond number | 29 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | OC(=O)C1(CCCC1)c1ccc(cc1)Cl |
