Base information
| Cat. No. | |
| CAS No. | 122001-32-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H17NO5 |
| Molecular Weight | 279.288 |
| Exact Mass | 279.111 |
| XLogP3 | -0.04102 |
| Mr | 68.9474 |
| PSA | 102.94 |
| Sequence | - |
| Atom number | 37 |
| Bond number | 38 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | N#CCc1ccc(cc1)O[C@@H]1O[C@@H](C)[C@@H]([C@H]([C@H]1O)O)O |
