Base information
| Cat. No. | |
| CAS No. | 5396-30-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H12ClN |
| Molecular Weight | 217.694 |
| Exact Mass | 217.066 |
| XLogP3 | 3.767 |
| Mr | 64.185 |
| PSA | 12.89 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 29 |
| Ring number | 3 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Clc1c2CCCCc2nc2c1cccc2 |
