Base information
| Cat. No. | |
| CAS No. | 14389-10-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H5N5 |
| Molecular Weight | 171.159 |
| Exact Mass | 171.054 |
| XLogP3 | 0.73838 |
| Mr | 44.3287 |
| PSA | 78.25 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 19 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | N#Cc1ccc(cc1)c1n[nH]nn1 |
