Base information
| Cat. No. | |
| CAS No. | 100-81-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H11N |
| Molecular Weight | 121.18 |
| Exact Mass | 121.089 |
| XLogP3 | 2.154 |
| Mr | 39.0814 |
| PSA | 26.02 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | NCc1cccc(c1)C |
