5-[2-(4-bromophenyl)-2-oxoethyl]-5-chloro-2,2-dimethyl-1,3-dioxane-4,6-dione
Chemical Structure Depiction of
5-[2-(4-bromophenyl)-2-oxoethyl]-5-chloro-2,2-dimethyl-1,3-dioxane-4,6-dione
5-[2-(4-bromophenyl)-2-oxoethyl]-5-chloro-2,2-dimethyl-1,3-dioxane-4,6-dione
Compound characteristics
| Compound ID: | 8007-0241 |
| Compound Name: | 5-[2-(4-bromophenyl)-2-oxoethyl]-5-chloro-2,2-dimethyl-1,3-dioxane-4,6-dione |
| Molecular Weight: | 375.6 |
| Molecular Formula: | C14 H12 Br Cl O5 |
| Smiles: | CC1(C)OC(C(CC(c2ccc(cc2)[Br])=O)(C(=O)O1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.937 |
| logD: | 2.937 |
| logSw: | -3.3608 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 54.691 |
| InChI Key: | TWSAAORAWFLYSA-UHFFFAOYSA-N |