2-butyl-5-[(3-iodo-4-methoxyphenyl)methylidene]-2-methyl-1,3-dioxane-4,6-dione
Chemical Structure Depiction of
2-butyl-5-[(3-iodo-4-methoxyphenyl)methylidene]-2-methyl-1,3-dioxane-4,6-dione
2-butyl-5-[(3-iodo-4-methoxyphenyl)methylidene]-2-methyl-1,3-dioxane-4,6-dione
Compound characteristics
| Compound ID: | 3553-1765 |
| Compound Name: | 2-butyl-5-[(3-iodo-4-methoxyphenyl)methylidene]-2-methyl-1,3-dioxane-4,6-dione |
| Molecular Weight: | 430.24 |
| Molecular Formula: | C17 H19 I O5 |
| Smiles: | CCCCC1(C)OC(C(=Cc2ccc(c(c2)I)OC)C(=O)O1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5625 |
| logD: | 4.5625 |
| logSw: | -4.616 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.464 |
| InChI Key: | AIAHMLRLAOIZFB-UHFFFAOYSA-N |