Benzene, 4-chloro-2-fluoro-1-(trifluoromethyl)-


Chemical Name: Benzene, 4-chloro-2-fluoro-1-(trifluoromethyl)-
CAS Number: 94444-59-4
Product Number: AG00II6D(AGN-PC-000RQ4)
Synonyms:
MDL No:
Molecular Formula: C7H3ClF4
Molecular Weight: 198.5453

Identification/Properties


Computed Properties
Molecular Weight:
198.545g/mol
XLogP3:
3.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
0
Exact Mass:
197.986g/mol
Monoisotopic Mass:
197.986g/mol
Topological Polar Surface Area:
0A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
156
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

Safety Information


NMR Spectrum


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Chemical Structure



4-Chloro-2-fluoro-1-(trifluoromethyl)benzene, also known as $name$, is a versatile compound widely used in chemical synthesis processes. Its unique chemical structure makes it a valuable building block in the creation of various organic compounds.One important application of 4-Chloro-2-fluoro-1-(trifluoromethyl)benzene is its role as a key intermediate in the synthesis of pharmaceuticals. By incorporating this compound into the molecular structure of new drugs, chemists can modulate the properties and behaviors of these medications, enhancing their efficacy and safety for patients.Additionally, 4-Chloro-2-fluoro-1-(trifluoromethyl)benzene is utilized in the development of agrochemicals, such as pesticides and herbicides. Its reactivity and functional groups allow for the creation of potent and targeted crop protection products that can help improve agricultural yield and sustainability.Furthermore, this compound finds applications in material science, where it can be used to synthesize polymers, resins, and other advanced materials with enhanced properties. Its compatibility with various reaction conditions and its stability make it a valuable component in the production of high-performance materials for industrial and technological applications.Overall, the versatility and utility of 4-Chloro-2-fluoro-1-(trifluoromethyl)benzene make it a valuable tool in the toolkit of chemists and researchers engaged in the synthesis of diverse organic compounds for pharmaceutical, agricultural, and materials science applications.