Base information
| Cat. No. | |
| CAS No. | 70289-29-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H12ClNO |
| Molecular Weight | 185.651 |
| Exact Mass | 185.061 |
| XLogP3 | 2.3291 |
| Mr | 50.3597 |
| PSA | 21.26 |
| Sequence | - |
| Atom number | 24 |
| Bond number | 24 |
| Ring number | 1 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CNCCOc1ccccc1Cl |
