Base information
| Cat. No. | |
| CAS No. | 2956-58-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H12N2O2 |
| Molecular Weight | 168.193 |
| Exact Mass | 168.09 |
| XLogP3 | 0.3726 |
| Mr | 45.6254 |
| PSA | 58.2 |
| Sequence | - |
| Atom number | 24 |
| Bond number | 23 |
| Ring number | 0 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | C=CC(=O)NCCNC(=O)C=C |
