Benzenamine, 3-fluoro-2-(trifluoromethyl)-


Chemical Name: Benzenamine, 3-fluoro-2-(trifluoromethyl)-
CAS Number: 123973-22-8
Product Number: AG000LAP(AGN-PC-00PY1A)
Synonyms:
MDL No:
Molecular Formula: C7H5F4N
Molecular Weight: 179.1149

Identification/Properties


Computed Properties
Molecular Weight:
179.118g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
0
Exact Mass:
179.036g/mol
Monoisotopic Mass:
179.036g/mol
Topological Polar Surface Area:
26A^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

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Chemical Structure



The compound 3-Fluoro-2-(trifluoromethyl)aniline plays a crucial role in chemical synthesis as a versatile building block. Its unique structure contains both a fluoro and trifluoromethyl group, allowing for a variety of reactions and transformations in organic chemistry. This compound can be utilized in the synthesis of complex pharmaceuticals, agrochemicals, and materials due to its ability to introduce specific functional groups with precision. Additionally, 3-Fluoro-2-(trifluoromethyl)aniline can serve as a valuable intermediate in the creation of novel compounds with enhanced properties, making it a valuable tool for synthetic chemists seeking to design and develop cutting-edge molecules.