Base information
| Cat. No. | |
| CAS No. | 117255-11-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H8N2O4 |
| Molecular Weight | 184.149 |
| Exact Mass | 184.048 |
| XLogP3 | -2.3899 |
| Mr | 40.5003 |
| PSA | 86.24 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 21 |
| Ring number | 1 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | OC(=O)Cn1cc[n+](c1)CC(=O)[O-] |
