Base information
| Cat. No. | |
| CAS No. | 3457-91-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C4H8N2O6 |
| Molecular Weight | 180.116 |
| Exact Mass | 180.038 |
| XLogP3 | 1.2296 |
| Mr | 39.722 |
| PSA | 110.1 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 19 |
| Ring number | 0 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | [O-][N+](=O)OCCCCO[N+](=O)[O-] |
