Base information
| Cat. No. | |
| CAS No. | 171096-32-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H8N2O4 |
| Molecular Weight | 184.149 |
| Exact Mass | 184.048 |
| XLogP3 | -0.809 |
| Mr | 42.7457 |
| PSA | 92.28 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 21 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | COC(=O)Cc1c(O)nc[nH]c1=O |
