Base information
| Cat. No. | |
| CAS No. | 54755-69-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H15NO5 |
| Molecular Weight | 253.251 |
| Exact Mass | 253.095 |
| XLogP3 | 1.1393 |
| Mr | 62.8523 |
| PSA | 95.86 |
| Sequence | - |
| Atom number | 33 |
| Bond number | 33 |
| Ring number | 1 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | O=C(OCc1ccccc1)NCCC(C(=O)O)O |
