Base information
| Cat. No. | |
| CAS No. | 108129-35-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H8N2O2 |
| Molecular Weight | 164.161 |
| Exact Mass | 164.059 |
| XLogP3 | 1.82568 |
| Mr | 42.9879 |
| PSA | 80.02 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | N#Cc1c(N)oc(c1C(=O)C)C |
