Base information
| Cat. No. | |
| CAS No. | 100-45-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H9N |
| Molecular Weight | 107.153 |
| Exact Mass | 107.073 |
| XLogP3 | 1.86628 |
| Mr | 32.924 |
| PSA | 23.79 |
| Sequence | - |
| Atom number | 17 |
| Bond number | 17 |
| Ring number | 1 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | N#CC1CCC=CC1 |
