Base information
| Cat. No. | |
| CAS No. | 106531-50-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C10H9NO4 |
| Molecular Weight | 207.183 |
| Exact Mass | 207.053 |
| XLogP3 | 1.7101 |
| Mr | 52.1185 |
| PSA | 72.56 |
| Sequence | - |
| Atom number | 24 |
| Bond number | 25 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | CCOC(=O)c1oc2c(c1O)ccnc2 |
