2-bromo-1-(4,4-difluorocyclohexyl)-ethanone


Chemical Name: 2-bromo-1-(4,4-difluorocyclohexyl)-ethanone
CAS Number: 1370601-11-8
Product Number: AG0012S2(AGN-PC-0WAIWL)
Synonyms:
MDL No:
Molecular Formula: C8H11BrF2O
Molecular Weight: 241.0731

Identification/Properties


Computed Properties
Molecular Weight:
241.076g/mol
XLogP3:
2.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
239.996g/mol
Monoisotopic Mass:
239.996g/mol
Topological Polar Surface Area:
17.1A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
172
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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Chemical Structure



2-Bromo-1-(4,4-difluorocyclohexyl)ethanone is a versatile chemical compound that finds applications in various aspects of chemical synthesis. It serves as a valuable building block in organic chemistry due to its unique structural properties. When used in chemical synthesis, this compound can act as a key intermediate for the preparation of diverse molecules and materials.One of the primary applications of 2-Bromo-1-(4,4-difluorocyclohexyl)ethanone is in the synthesis of pharmaceuticals. Its functional groups and reactivity make it a valuable precursor for the creation of biologically active compounds. By incorporating this compound into the synthesis of pharmaceutical agents, researchers can tailor the properties and activities of new drugs for specific medical applications.Additionally, 2-Bromo-1-(4,4-difluorocyclohexyl)ethanone plays a crucial role in the development of agrochemicals and specialty chemicals. Its chemical structure allows for modifications that can impart desired characteristics to the final products. Through strategic synthetic pathways involving this compound, chemists can access novel pesticides, herbicides, and specialty materials with enhanced performance and properties.Moreover, this compound is utilized in material science for the fabrication of advanced polymers and functional materials. Its presence in the molecular design of polymers can influence their physical and chemical attributes, leading to materials with tailored properties such as enhanced adhesion, thermal stability, or mechanical strength. By incorporating 2-Bromo-1-(4,4-difluorocyclohexyl)ethanone into polymer synthesis, researchers can explore new possibilities for creating innovative materials for various industrial applications.