Base information
| Cat. No. | |
| CAS No. | 180690-93-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H17NO4 |
| Molecular Weight | 251.278 |
| Exact Mass | 251.116 |
| XLogP3 | 2.9277 |
| Mr | 68.5672 |
| PSA | 64.63 |
| Sequence | - |
| Atom number | 35 |
| Bond number | 35 |
| Ring number | 1 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | COc1cccc(c1NC(=O)OC(C)(C)C)C=O |
