Base information
| Cat. No. | |
| CAS No. | 118409-57-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C10H6N2O2 |
| Molecular Weight | 186.167 |
| Exact Mass | 186.043 |
| XLogP3 | 1.52836 |
| Mr | 49.691 |
| PSA | 88.04 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | N#CC(=Cc1ccc(c(c1)O)O)C#N |
