5-[(4-bromophenyl)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione
Chemical Structure Depiction of
5-[(4-bromophenyl)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione
5-[(4-bromophenyl)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione
Compound characteristics
| Compound ID: | 4338-0958 |
| Compound Name: | 5-[(4-bromophenyl)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione |
| Molecular Weight: | 311.13 |
| Molecular Formula: | C13 H11 Br O4 |
| Smiles: | CC1(C)OC(C(=Cc2ccc(cc2)[Br])C(=O)O1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2069 |
| logD: | 3.2069 |
| logSw: | -3.3159 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.444 |
| InChI Key: | BYJCZLGELPMDTC-UHFFFAOYSA-N |