2-butyl-5-[(4-fluorophenyl)methylidene]-2-methyl-1,3-dioxane-4,6-dione
Chemical Structure Depiction of
2-butyl-5-[(4-fluorophenyl)methylidene]-2-methyl-1,3-dioxane-4,6-dione
2-butyl-5-[(4-fluorophenyl)methylidene]-2-methyl-1,3-dioxane-4,6-dione
Compound characteristics
| Compound ID: | 5254-3322 |
| Compound Name: | 2-butyl-5-[(4-fluorophenyl)methylidene]-2-methyl-1,3-dioxane-4,6-dione |
| Molecular Weight: | 292.3 |
| Molecular Formula: | C16 H17 F O4 |
| Smiles: | CCCCC1(C)OC(C(=Cc2ccc(cc2)F)C(=O)O1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8176 |
| logD: | 3.8176 |
| logSw: | -3.9685 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.833 |
| InChI Key: | XKZZMVMLUBNQNU-UHFFFAOYSA-N |