Base information
| Cat. No. | |
| CAS No. | 117977-19-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H19NO5- |
| Molecular Weight | 269.294 |
| Exact Mass | 269.126 |
| XLogP3 | -0.6571 |
| Mr | 72.7723 |
| PSA | 91.18 |
| Sequence | - |
| Atom number | 38 |
| Bond number | 38 |
| Ring number | 1 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | COCCCOC1=C(C)[C](=NC=C1)(CO)CC(=O)[O-] |
