Base information
| Cat. No. | |
| CAS No. | 650597-74-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H11NO4 |
| Molecular Weight | 221.209 |
| Exact Mass | 221.069 |
| XLogP3 | 0.6805 |
| Mr | 56.1957 |
| PSA | 76.23 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 28 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COC(=O)c1cc2C(=O)CCCc2[nH]c1=O |
