Base information
| Cat. No. | |
| CAS No. | 107-13-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C3H3N |
| Molecular Weight | 53.0626 |
| Exact Mass | 53.0265 |
| XLogP3 | 0.69598 |
| Mr | 15.81 |
| PSA | 23.79 |
| Sequence | - |
| Atom number | 7 |
| Bond number | 6 |
| Ring number | 0 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | C=CC#N |
