Base information
| Cat. No. | |
| CAS No. | 874-86-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H6ClN |
| Molecular Weight | 151.593 |
| Exact Mass | 151.019 |
| XLogP3 | 2.29708 |
| Mr | 40.919 |
| PSA | 23.79 |
| Sequence | - |
| Atom number | 16 |
| Bond number | 16 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | ClCc1ccc(cc1)C#N |
