Base information
| Cat. No. | |
| CAS No. | 358629-47-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H12N2O2 |
| Molecular Weight | 168.193 |
| Exact Mass | 168.09 |
| XLogP3 | 0.6361 |
| Mr | 47.9004 |
| PSA | 63.4 |
| Sequence | - |
| Atom number | 24 |
| Bond number | 24 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | C/C=C(\N1CCCC1=O)/C(=O)N |
