(5-chloro-2-propoxyphenyl)boronic acid


Chemical Name: (5-chloro-2-propoxyphenyl)boronic acid
CAS Number: 849062-29-9
Product Number: AG003MNU(AGN-PC-00UQK2)
Synonyms:
MDL No:
Molecular Formula: C9H12BClO3
Molecular Weight: 214.4538

Identification/Properties


Properties
MP:
92-97°C(lit.)
Storage:
2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
214.452g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
214.057g/mol
Monoisotopic Mass:
214.057g/mol
Topological Polar Surface Area:
49.7A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
168
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



B-(5-Chloro-2-propoxyphenyl)boronic acid is a valuable reagent widely used in chemical synthesis for its unique properties and versatility. This compound serves as a key building block in the development of novel pharmaceuticals, agrochemicals, and materials due to its ability to participate in diverse cross-coupling reactions.In organic synthesis, B-(5-Chloro-2-propoxyphenyl)boronic acid acts as a boronic ester, forming stable complexes with various transition metals such as palladium and copper. These complexes play a crucial role in Suzuki-Miyaura coupling reactions, enabling the selective formation of carbon-carbon bonds. By utilizing this boronic acid derivative, chemists can efficiently construct complex molecular structures with high precision and selectivity.Moreover, the chloro and propoxy substituents on the phenyl ring of the boronic acid molecule impart specific reactivity, allowing for further functionalization and modification. This enables the fine-tuning of chemical structures and properties, making B-(5-Chloro-2-propoxyphenyl)boronic acid a valuable tool in the synthesis of advanced organic compounds.Overall, the application of B-(5-Chloro-2-propoxyphenyl)boronic acid in chemical synthesis showcases its significance in modern organic chemistry, offering researchers a powerful means to access a wide range of novel compounds with potential applications across various industries.