4-BROMO-2-METHYLBENZO[D]OXAZOLE


Chemical Name: 4-BROMO-2-METHYLBENZO[D]OXAZOLE
CAS Number: 217326-69-7
Product Number: AG00BIFI(AGN-PC-0WAKCL)
Synonyms:
MDL No:
Molecular Formula: C8H6BrNO
Molecular Weight: 212.0433

Identification/Properties


Computed Properties
Molecular Weight:
212.046g/mol
XLogP3:
2.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
210.963g/mol
Monoisotopic Mass:
210.963g/mol
Topological Polar Surface Area:
26A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
153
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#:
-
Hazard Statements:
H302
Precautionary Statements:
P261-P280-P305+P351+P338-P304+P340
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



4-Bromo-2-methyl-1,3-benzoxazole, also known as $name$, is a versatile chemical compound commonly used in chemical synthesis. In the realm of organic chemistry, this compound plays a crucial role as a building block in the creation of various pharmaceuticals, agrochemicals, and materials.One of the primary applications of 4-Bromo-2-methyl-1,3-benzoxazole is in the synthesis of heterocyclic compounds. Due to its unique structure and reactivity, this compound serves as a key intermediate in the construction of more complex organic molecules. Its bromo and methyl functional groups make it a valuable precursor for the introduction of additional substituents, allowing chemists to tailor the properties of the final product.Additionally, 4-Bromo-2-methyl-1,3-benzoxazole is often utilized in the development of new drugs and biologically active compounds. By incorporating this compound into the molecular structure of potential pharmaceuticals, researchers can explore its impact on biological activity and pharmacological properties. This compound's presence in the synthesis of medicinal agents highlights its significance in the pharmaceutical industry.Furthermore, 4-Bromo-2-methyl-1,3-benzoxazole is employed in the preparation of specialized materials with specific properties. Its use as a starting material in polymer chemistry, for instance, enables the creation of polymers with tailored characteristics such as solubility, thermal stability, or conductivity. The versatility of this compound makes it a valuable tool in the development of advanced materials for a wide range of industrial applications.In conclusion, the role of 4-Bromo-2-methyl-1,3-benzoxazole in chemical synthesis is indispensable, serving as a fundamental building block for the design and fabrication of diverse organic molecules, pharmaceuticals, agrochemicals, and materials. Its unique structure and reactivity make it a valuable asset in the arsenal of synthetic chemists seeking to innovate and create novel compounds for various industrial sectors.