Base information
| Cat. No. | |
| CAS No. | 71879-56-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H12ClNO2 |
| Molecular Weight | 201.65 |
| Exact Mass | 201.056 |
| XLogP3 | 2.2909 |
| Mr | 52.3608 |
| PSA | 50.19 |
| Sequence | - |
| Atom number | 25 |
| Bond number | 24 |
| Ring number | 1 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | OC(=O)CCCc1ccncc1.Cl |
