Base information
| Cat. No. | |
| CAS No. | 4474-60-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C5H5NO2 |
| Molecular Weight | 111.099 |
| Exact Mass | 111.032 |
| XLogP3 | 0.4249 |
| Mr | 28.1325 |
| PSA | 46.5 |
| Sequence | - |
| Atom number | 13 |
| Bond number | 12 |
| Ring number | 0 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | CC(=C)C(=O)N=C=O |
