2-Benzofurancarboxaldehyde, 5-bromo-


Chemical Name: 2-Benzofurancarboxaldehyde, 5-bromo-
CAS Number: 23145-16-6
Product Number: AG002MCU(AGN-PC-0KL7LN)
Synonyms:
MDL No:
Molecular Formula: C9H5BrO2
Molecular Weight: 225.0388

Identification/Properties


Properties
MP:
129 °C
BP:
312.4°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
225.041g/mol
XLogP3:
2.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
223.947g/mol
Monoisotopic Mass:
223.947g/mol
Topological Polar Surface Area:
30.2A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
183
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:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H319
Precautionary Statements:
P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



5-Bromobenzofuran-2-carbaldehyde, also known as $name$, is a versatile chemical compound commonly used in chemical synthesis with a wide range of applications. In organic chemistry, it serves as a key building block for the synthesis of various functionalized compounds due to its reactive aldehyde group and bromine substituent.One of the main applications of 5-Bromobenzofuran-2-carbaldehyde is in the preparation of heterocyclic compounds. Its unique molecular structure allows for the formation of complex ring systems through different cyclization reactions. By utilizing the aldehyde functionality, this compound can participate in numerous condensation reactions to produce a variety of fused heterocyclic rings, which are crucial in the development of pharmaceuticals, agrochemicals, and materials science.Moreover, 5-Bromobenzofuran-2-carbaldehyde is often employed as a key intermediate in the synthesis of biologically active molecules. Its ability to undergo diverse chemical transformations makes it a valuable starting material for the construction of bioactive compounds with potential therapeutic properties. By modifying the bromine and aldehyde groups, chemists can create structurally diverse molecules for biological screening and drug discovery efforts.Overall, the strategic incorporation of 5-Bromobenzofuran-2-carbaldehyde in chemical synthesis enables the efficient and targeted production of complex organic molecules with significant applications in drug development, materials chemistry, and other scientific fields.