Base information
| Cat. No. | |
| CAS No. | 7696-12-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C19H25NO4 |
| Molecular Weight | 331.406 |
| Exact Mass | 331.178 |
| XLogP3 | 2.9028 |
| Mr | 94.393 |
| PSA | 63.68 |
| Sequence | - |
| Atom number | 49 |
| Bond number | 51 |
| Ring number | 3 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | O=C(C1C(C1(C)C)C=C(C)C)OCN1C(=O)C2=C(C1=O)CCCC2 |
