ethyl 2-(4-bromophenyl)-1,3-thiazole-4-carboxylate


Chemical Name: ethyl 2-(4-bromophenyl)-1,3-thiazole-4-carboxylate
CAS Number: 885278-75-1
Product Number: AG0045F8(AGN-PC-078TIO)
Synonyms:
MDL No:
Molecular Formula: C12H10BrNO2S
Molecular Weight: 312.1823

Identification/Properties


Properties
MP:
89 - 91 °C
BP:
404.6°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
312.181g/mol
XLogP3:
3.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
4
Exact Mass:
310.962g/mol
Monoisotopic Mass:
310.962g/mol
Topological Polar Surface Area:
67.4A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
269
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


NMR Spectrum


Other Analytical Data


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Chemical Structure



Ethyl 2-(4-bromophenyl)thiazole-4-carboxylate is a versatile compound commonly employed in chemical synthesis as a key building block for the creation of various pharmaceuticals, agrochemicals, and advanced materials. Its unique structure and reactivity make it a valuable tool in the development of complex organic molecules through various synthetic routes, including Suzuki-Miyaura cross-coupling reactions, Heck reactions, and nucleophilic substitution reactions. This compound serves as an important intermediate in the production of diverse bioactive compounds with potential applications in drug discovery and materials science. With its role in enabling the formation of intricate chemical structures, Ethyl 2-(4-bromophenyl)thiazole-4-carboxylate plays a crucial role in advancing the field of organic chemistry and facilitating the creation of novel compounds with tailored properties and functions.