CAS 898757-23-8

1-(3-bromo-4-chloro-phenyl)-4-(5,5-dimethyl-1,3-dioxan-2-yl)butan-1-one

Description:

1-(3-bromo-4-chloro-phenyl)-4-(5,5-dimethyl-1,3-dioxan-2-yl)butan-1-one, identified by its CAS number 898757-23-8, is a synthetic organic compound characterized by its complex structure, which includes a phenyl ring substituted with bromine and chlorine atoms, as well as a butanone moiety. The presence of the 5,5-dimethyl-1,3-dioxan-2-yl group contributes to its unique chemical properties, potentially influencing its solubility, reactivity, and biological activity. This compound may exhibit interesting pharmacological properties due to its structural features, making it a candidate for research in medicinal chemistry. Its synthesis typically involves multi-step organic reactions, and it may be utilized in various applications, including drug development and chemical synthesis. Safety and handling precautions are essential when working with this compound, as halogenated organic compounds can pose health risks. Overall, the compound's characteristics, including its molecular weight, melting point, and solubility, would be critical for understanding its behavior in different chemical environments.

Formula: C₁₆H₂₀BrClO₃

InChI: InChI=1/C16H20BrClO3/c1-16(2)9-20-15(21-10-16)5-3-4-14(19)11-6-7-13(18)12(17)8-11/h6-8,15H,3-5,9-10H2,1-2H3

SMILES: CC1(C)COC(CCCC(=O)c2ccc(c(c2)Br)Cl)OC1