1,3-dibromo-5-fluoro-2-nitrobenzene


Chemical Name: 1,3-dibromo-5-fluoro-2-nitrobenzene
CAS Number: 898128-02-4
Product Number: AG019EYA(AG019EYA)
Synonyms:
MDL No:
Molecular Formula: C6H2Br2FNO2
Molecular Weight: 298.8920

Identification/Properties


Computed Properties
Molecular Weight:
298.893g/mol
XLogP3:
3.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
298.842g/mol
Monoisotopic Mass:
296.844g/mol
Topological Polar Surface Area:
45.8A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
175
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


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



1,3-Dibromo-5-fluoro-2-nitrobenzene is a versatile compound widely utilized in chemical synthesis for its unique properties. This compound serves as a key building block in the preparation of various organic molecules due to its functional groups which allow for selective transformations. In particular, 1,3-Dibromo-5-fluoro-2-nitrobenzene is commonly employed in the synthesis of pharmaceutical intermediates, agrochemicals, and materials with specialized properties.In organic synthesis, the bromine substituents on the benzene ring of 1,3-Dibromo-5-fluoro-2-nitrobenzene can undergo substitution reactions, enabling the introduction of different functional groups at specific positions. The nitro group provides an opportunity for further derivatization through reduction or other chemical reactions, leading to the synthesis of diverse compounds. Additionally, the fluorine atom in the molecule can participate in various reactions, offering a range of possibilities for synthetic manipulations.Furthermore, the presence of multiple halogen atoms in 1,3-Dibromo-5-fluoro-2-nitrobenzene imparts enhanced reactivity and compatibility with certain reaction conditions, making it a valuable tool in the development of complex molecular structures. Its strategic placement of functional groups enables chemists to control and direct the synthesis towards the desired products efficiently.Overall, the utility of 1,3-Dibromo-5-fluoro-2-nitrobenzene in chemical synthesis lies in its role as a versatile precursor for the construction of diverse organic compounds with tailored properties and applications in various sectors of the chemical industry.