Base information
| Cat. No. | |
| CAS No. | 2739-97-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H6N2 |
| Molecular Weight | 118.136 |
| Exact Mass | 118.053 |
| XLogP3 | 1.14768 |
| Mr | 33.759 |
| PSA | 36.68 |
| Sequence | - |
| Atom number | 15 |
| Bond number | 15 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | N#CCc1ccccn1 |
