Base information
| Cat. No. | |
| CAS No. | 557770-89-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H12N2O3 |
| Molecular Weight | 220.225 |
| Exact Mass | 220.085 |
| XLogP3 | 0.6843 |
| Mr | 59.6315 |
| PSA | 75.21 |
| Sequence | - |
| Atom number | 28 |
| Bond number | 29 |
| Ring number | 2 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | OCCCOc1ccc2c(c1)nc[nH]c2=O |
