Base information
| Cat. No. | |
| CAS No. | 127408-31-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H16N2O4 |
| Molecular Weight | 276.288 |
| Exact Mass | 276.111 |
| XLogP3 | 1.36898 |
| Mr | 69.5613 |
| PSA | 93.79 |
| Sequence | - |
| Atom number | 36 |
| Bond number | 37 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | N#Cc1ccc2c(c1)[C@@H](N(C(=O)C)O)[C@@H](C(O2)(C)C)O |
