Base information
| Cat. No. | |
| CAS No. | 6214-59-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H10N2O4 |
| Molecular Weight | 198.176 |
| Exact Mass | 198.064 |
| XLogP3 | -0.6803 |
| Mr | 48.9365 |
| PSA | 92.16 |
| Sequence | - |
| Atom number | 24 |
| Bond number | 24 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | OC(=O)CCn1cc(C)c(=O)[nH]c1=O |
