Base information
| Cat. No. | |
| CAS No. | 40836-55-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H12ClN3 |
| Molecular Weight | 161.633 |
| Exact Mass | 161.072 |
| XLogP3 | 1.8033 |
| Mr | 42.8401 |
| PSA | 54.7 |
| Sequence | - |
| Atom number | 22 |
| Bond number | 21 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | NCCCc1c[nH]cn1.Cl |
