Base information
| Cat. No. | |
| CAS No. | 115948-87-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H12N2O4 |
| Molecular Weight | 248.235 |
| Exact Mass | 248.08 |
| XLogP3 | 0.5546 |
| Mr | 66.2835 |
| PSA | 92.16 |
| Sequence | - |
| Atom number | 30 |
| Bond number | 31 |
| Ring number | 2 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | OC(=O)CCCn1c(=O)[nH]c2c(c1=O)cccc2 |
