Base information
| Cat. No. | |
| CAS No. | 127680-85-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H17N3 |
| Molecular Weight | 203.283 |
| Exact Mass | 203.142 |
| XLogP3 | 2.57968 |
| Mr | 62.387 |
| PSA | 39.92 |
| Sequence | - |
| Atom number | 32 |
| Bond number | 32 |
| Ring number | 1 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | CCCN(c1nccc(c1)C#N)CCC |
