Base information
| Cat. No. | |
| CAS No. | 5588-21-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H15NO4 |
| Molecular Weight | 237.252 |
| Exact Mass | 237.1 |
| XLogP3 | 1.9112 |
| Mr | 63.7234 |
| PSA | 70.78 |
| Sequence | - |
| Atom number | 32 |
| Bond number | 32 |
| Ring number | 1 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | COc1cc(C=CC(=O)N)cc(c1OC)OC |
