4-(4-Bromophenyl)thiazole-2-carboxylic Acid


Chemical Name: 4-(4-Bromophenyl)thiazole-2-carboxylic Acid
CAS Number: 886366-94-5
Product Number: AG003K2Q(AGN-PC-0NTCOY)
Synonyms:
MDL No: MFCD07375210
Molecular Formula: C10H6BrNO2S
Molecular Weight: 284.1291

Identification/Properties


Properties
Storage:
2-8℃;Keep in dry area;
Computed Properties
Molecular Weight:
284.127g/mol
XLogP3:
3.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
282.93g/mol
Monoisotopic Mass:
282.93g/mol
Topological Polar Surface Area:
78.4A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
244
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-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



4-(4-Bromophenyl)thiazole-2-carboxylic acid is a versatile compound widely utilized in chemical synthesis as a building block for the preparation of various organic molecules. This compound serves as a key intermediate in the synthesis of pharmaceuticals, agrochemicals, and materials due to its unique structural properties and reactivity.In organic chemistry, 4-(4-Bromophenyl)thiazole-2-carboxylic acid is commonly employed as a precursor for the construction of thiophene-containing compounds. The thiazole moiety in the structure confers desirable electronic and steric properties, making it valuable for designing new functional materials and bioactive molecules. This compound can be functionalized at different positions, allowing for the introduction of diverse functional groups to modulate its properties for specific applications.Furthermore, 4-(4-Bromophenyl)thiazole-2-carboxylic acid is utilized in the development of novel inhibitors, catalysts, and ligands in medicinal chemistry and drug discovery. Its structural scaffold can be modified to target specific biological pathways or enzyme activities, enabling the creation of potential drug candidates with enhanced pharmacological properties. Additionally, this compound can participate in various cross-coupling reactions, cycloadditions, and functional group transformations to access structurally complex molecules efficiently.Overall, the strategic use of 4-(4-Bromophenyl)thiazole-2-carboxylic acid in chemical synthesis offers a valuable toolbox for generating diverse compounds with tailored functionalities and applications across multiple scientific disciplines.