Base information
| Cat. No. | |
| CAS No. | 108-42-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H6ClN |
| Molecular Weight | 127.572 |
| Exact Mass | 127.019 |
| XLogP3 | 2.5034 |
| Mr | 35.8564 |
| PSA | 26.02 |
| Sequence | - |
| Atom number | 14 |
| Bond number | 14 |
| Ring number | 1 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Nc1cccc(c1)Cl |
