Base information
| Cat. No. | |
| CAS No. | 13048-33-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H18O4 |
| Molecular Weight | 226.269 |
| Exact Mass | 226.121 |
| XLogP3 | 2.0052 |
| Mr | 61.42 |
| PSA | 52.6 |
| Sequence | - |
| Atom number | 34 |
| Bond number | 33 |
| Ring number | 0 |
| Rotor number | 11 |
| Residues number | 0 |
| Canonical smiles | C=CC(=O)OCCCCCCOC(=O)C=C |
