HuagongsheHuagongshe Chemistry Print Report · For research reference only
3-[5-(3,4-Dichlorophenyl)-2-furyl]-1-(4-fluorophenyl)-2-propen-1-one
3-[5-(3,4-dichlorophenyl)-2-furyl]-1-(4-fluorophenyl)-2-propen-1-one · 2-Propen-1-one, 3-[5-(3,4-dichlorophenyl)-2-furanyl]-1-(4-fluorophenyl)-, (2E)-
![3-[5-(3,4-Dichlorophenyl)-2-furyl]-1-(4-fluorophenyl)-2-propen-1-one molecular structure](/img/chemical/178737726.png)
Identifiers & Physical Properties
| CAS No. | 1346791-10-3 |
|---|---|
| Molecular formula | C19H11Cl2FO2 |
| Average molar mass | 361.2 g/mol |
| SMILES | O=C(/C=C/c1ccc(-c2ccc(Cl)c(Cl)c2)o1)c1ccc(F)cc1 |
| InChIKey | KQEXRBGZAHCHRN-RMKNXTFCSA-N |
| ChEMBL | CHEMBL2235068 |
Chemical & Physical Properties
| XLogP | 5.8 |
|---|---|
| Topological polar surface area | 30.2 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 4 |
| Heavy atoms | 24 |
| Formal charge | 0 |
| Complexity | 462 |
| Melting point | 133-135 °C |
| Boiling point | 500.8±50.0 °C(Predicted) |
| Density | 1.357±0.06 g/cm3(Predicted) |