Base information
| Cat. No. | |
| CAS No. | 141041-80-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H14N2O2 |
| Molecular Weight | 170.209 |
| Exact Mass | 170.106 |
| XLogP3 | 1.81408 |
| Mr | 44.8327 |
| PSA | 62.12 |
| Sequence | - |
| Atom number | 26 |
| Bond number | 25 |
| Ring number | 0 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CC(NC(=O)OC(C)(C)C)C#N |
