5-[(3,5-dibromo-4-hydroxyphenyl)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione
Chemical Structure Depiction of
5-[(3,5-dibromo-4-hydroxyphenyl)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione
5-[(3,5-dibromo-4-hydroxyphenyl)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione
Compound characteristics
| Compound ID: | 4338-0986 |
| Compound Name: | 5-[(3,5-dibromo-4-hydroxyphenyl)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione |
| Molecular Weight: | 406.02 |
| Molecular Formula: | C13 H10 Br2 O5 |
| Smiles: | CC1(C)OC(C(=Cc2cc(c(c(c2)[Br])O)[Br])C(=O)O1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0774 |
| logD: | 2.6573 |
| logSw: | -2.956 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.923 |
| InChI Key: | UQLQCHVTPSOEGB-UHFFFAOYSA-N |