Base information
| Cat. No. | |
| CAS No. | 42365-52-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H12ClNO |
| Molecular Weight | 173.64 |
| Exact Mass | 173.061 |
| XLogP3 | 2.6562 |
| Mr | 47.5724 |
| PSA | 35.25 |
| Sequence | - |
| Atom number | 23 |
| Bond number | 22 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COc1ccccc1CN.Cl |
