Base information
| Cat. No. | |
| CAS No. | 143612-79-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H13ClN2 |
| Molecular Weight | 232.709 |
| Exact Mass | 232.077 |
| XLogP3 | 3.60108 |
| Mr | 67.1967 |
| PSA | 39.58 |
| Sequence | - |
| Atom number | 29 |
| Bond number | 30 |
| Ring number | 2 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | ClCCCCc1c[nH]c2c1cc(cc2)C#N |
