Base information
| Cat. No. | |
| CAS No. | 3179-90-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H18N2O6 |
| Molecular Weight | 358.345 |
| Exact Mass | 358.116 |
| XLogP3 | 0.8276 |
| Mr | 94.344 |
| PSA | 139.12 |
| Sequence | - |
| Atom number | 44 |
| Bond number | 46 |
| Ring number | 3 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | OCCNc1ccc(c2c1C(=O)c1c(C2=O)c(O)ccc1O)NCCO |
