HuagongsheHuagongshe Chemistry Print Report · For research reference only
Tert-butyl 3-(3-ethoxy-3-oxoprop-1-enyl)benzoate
Identifiers & Physical Properties
| Molecular formula | C16H20O4 |
|---|---|
| Average molar mass | 276.33 g/mol |
| SMILES | CCOC(=O)C=Cc1cccc(C(=O)OC(C)(C)C)c1 |
| InChIKey | JQUQBVGPFCOXGV-UHFFFAOYSA-N |
| PubChem CID | 90725035 |
Chemical & Physical Properties
| XLogP | 3.4 |
|---|---|
| Topological polar surface area | 52.6 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 7 |
| Heavy atoms | 20 |
| Formal charge | 0 |
| Complexity | 365 |