Base information
| Cat. No. | |
| CAS No. | 77-57-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H13N |
| Molecular Weight | 171.238 |
| Exact Mass | 171.105 |
| XLogP3 | 3.02198 |
| Mr | 52.961 |
| PSA | 23.79 |
| Sequence | - |
| Atom number | 26 |
| Bond number | 27 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | N#CC1(CCCC1)c1ccccc1 |
