Base information
| Cat. No. | |
| CAS No. | 714237-94-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C10H6N2O2 |
| Molecular Weight | 186.167 |
| Exact Mass | 186.043 |
| XLogP3 | 1.21656 |
| Mr | 47.1515 |
| PSA | 73.88 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | N#Cc1ccc(c(c1)C(=O)OC)C#N |
