Base information
| Cat. No. | |
| CAS No. | 402956-36-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C10H7N |
| Molecular Weight | 141.169 |
| Exact Mass | 141.058 |
| XLogP3 | 1.8126 |
| Mr | 46.7164 |
| PSA | 26.02 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 18 |
| Ring number | 1 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | C#Cc1cc(N)cc(c1)C#C |
