[4-fluoro-3-(oxan-2-yloxy)phenyl]boronic acid


Chemical Name: [4-fluoro-3-(oxan-2-yloxy)phenyl]boronic acid
CAS Number: 1217501-17-1
Product Number: AG0015SL(AGN-PC-09PYXT)
Synonyms:
MDL No:
Molecular Formula: C11H14BFO4
Molecular Weight: 240.0359

Identification/Properties


Properties
BP:
420.6±55.0°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Computed Properties
Molecular Weight:
240.037g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
3
Exact Mass:
240.097g/mol
Monoisotopic Mass:
240.097g/mol
Topological Polar Surface Area:
58.9A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
242
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



The (4-Fluoro-3-((tetrahydro-2H-pyran-2-yl)oxy)phenyl)boronic acid is a versatile compound widely used in chemical synthesis. This compound plays a crucial role as a boronic acid building block in the formation of various organic molecules through Suzuki-Miyaura cross-coupling reactions. With its unique structure containing a boronic acid moiety and a tetrahydro-2H-pyran-2-yl ether group, this compound facilitates selective C-C bond formations in complex molecule synthesis. Additionally, the fluoro substituent enhances the reactivity and selectivity of the compound in coupling reactions, making it a valuable tool in medicinal chemistry, materials science, and agrochemical synthesis. The (4-Fluoro-3-((tetrahydro-2H-pyran-2-yl)oxy)phenyl)boronic acid offers chemists a powerful building block for the construction of diverse molecular architectures with potential applications across various fields of research and industry.