Thiazole, 5-bromo-4-methyl-


Chemical Name: Thiazole, 5-bromo-4-methyl-
CAS Number: 111600-83-0
Product Number: AG003485(AGN-PC-003DOM)
Synonyms:
MDL No: MFCD12026322
Molecular Formula: C4H4BrNS
Molecular Weight: 178.0503

Identification/Properties


Properties
MP:
138℃
BP:
207.334°C at 760 mmHg
Storage:
2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
178.047g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
176.925g/mol
Monoisotopic Mass:
176.925g/mol
Topological Polar Surface Area:
41.1A^2
Heavy Atom Count:
7
Formal Charge:
0
Complexity:
68.7
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-H320-H335
Precautionary Statements:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



5-Bromo-4-methylthiazole is a versatile building block in chemical synthesis, commonly used for the preparation of various pharmaceuticals, agrochemicals, and organic compounds. Its unique structure and reactivity make it a valuable intermediate in the synthesis of complex molecules. This compound is particularly useful in the formation of heterocyclic compounds, which are prevalent in drug discovery and material science. Additionally, 5-Bromo-4-methylthiazole can serve as a key component in the development of novel chemical entities with diverse biological activities. Its application in organic synthesis is vital for advancing research in medicinal chemistry and chemical biology.