Benzenamine, 4-chloro-2-nitro-5-(trifluoromethyl)-


Chemical Name: Benzenamine, 4-chloro-2-nitro-5-(trifluoromethyl)-
CAS Number: 167415-22-7
Product Number: AG001XD9(AGN-PC-0KK8O0)
Synonyms:
MDL No: MFCD03094264
Molecular Formula: C7H4ClF3N2O2
Molecular Weight: 240.5671

Identification/Properties


Computed Properties
Molecular Weight:
240.566g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
0
Exact Mass:
239.991g/mol
Monoisotopic Mass:
239.991g/mol
Topological Polar Surface Area:
71.8A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
256
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



5-Amino-2-chloro-4-nitrobenzotrifluoride (ACNBF) is a versatile chemical compound widely utilized in chemical synthesis due to its unique properties and reactivity. This compound serves as a valuable building block in the synthesis of various pharmaceuticals, agrochemicals, and specialty chemicals.One key application of 5-Amino-2-chloro-4-nitrobenzotrifluoride is its use as a precursor in the synthesis of fluorinated organic compounds. The trifluoromethyl group present in ACNBF imparts valuable fluorine atoms to the molecules being synthesized. Fluorinated organic compounds are highly sought after in the pharmaceutical industry due to their unique biological activities and improved pharmacokinetic properties.Additionally, 5-Amino-2-chloro-4-nitrobenzotrifluoride can be employed in the synthesis of dyes and pigments. Its nitro and amino functional groups allow for versatile chemical modifications, enabling the creation of a wide range of colorful and chemically robust compounds used in various industrial applications.Furthermore, ACNBF can be utilized in the preparation of specialty chemicals such as surfactants, polymers, and materials with specific electronic properties. Its trifluoromethyl and nitro groups make it a valuable starting material for designing molecules with desired functionalities and characteristics.Overall, the application of 5-Amino-2-chloro-4-nitrobenzotrifluoride in chemical synthesis extends to diverse fields, highlighting its importance as a key intermediate in the production of valuable compounds with broad industrial applications.