5-[(2H-1,3-benzodioxol-5-yl)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione
Chemical Structure Depiction of
5-[(2H-1,3-benzodioxol-5-yl)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione
5-[(2H-1,3-benzodioxol-5-yl)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione
Compound characteristics
| Compound ID: | 1889-2650 |
| Compound Name: | 5-[(2H-1,3-benzodioxol-5-yl)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione |
| Molecular Weight: | 276.24 |
| Molecular Formula: | C14 H12 O6 |
| Smiles: | CC1(C)OC(C(=Cc2ccc3c(c2)OCO3)C(=O)O1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2698 |
| logD: | 2.2698 |
| logSw: | -2.6937 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.56 |
| InChI Key: | CDTLWWMBMTUCGU-UHFFFAOYSA-N |