Base information
| Cat. No. | |
| CAS No. | 1263166-91-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C17H17NO5 |
| Molecular Weight | 315.321 |
| Exact Mass | 315.111 |
| XLogP3 | 4.073 |
| Mr | 85.434 |
| PSA | 81.35 |
| Sequence | - |
| Atom number | 40 |
| Bond number | 42 |
| Ring number | 3 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | O=C(Oc1ccc(cc1)N(=O)=O)OC[C@@H]1[C@H]2[C@@H]1CCC#CCC2 |
