Base information
| Cat. No. | |
| CAS No. | 105-63-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H8N2O4 |
| Molecular Weight | 172.139 |
| Exact Mass | 172.048 |
| XLogP3 | 0.0017 |
| Mr | 38.0651 |
| PSA | 98.49 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 19 |
| Ring number | 0 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | COC(=O)/C=C\C(=O)NC(=O)N |
