Benzothiazole, 2-[4-(bromomethyl)phenyl]-6-methoxy-


Chemical Name: Benzothiazole, 2-[4-(bromomethyl)phenyl]-6-methoxy-
CAS Number: 101078-75-5
Product Number: AG0003O1(AGN-PC-00N8FY)
Synonyms:
MDL No:
Molecular Formula: C15H12BrNOS
Molecular Weight: 334.2309

Identification/Properties


Properties
Storage:
Room Temperature;
Computed Properties
Molecular Weight:
334.231g/mol
XLogP3:
4.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
332.982g/mol
Monoisotopic Mass:
332.982g/mol
Topological Polar Surface Area:
50.4A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
296
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



2-(4-(Bromomethyl)phenyl)-6-methoxybenzo[d]thiazole is a versatile compound that finds widespread application in chemical synthesis. Due to its unique structure, this compound is commonly used as a key building block in the synthesis of various organic molecules and pharmaceutical compounds. Its bromomethyl and methoxy functional groups provide opportunities for selective functionalization, making it a valuable intermediate in the preparation of complex chemical structures. In addition, the benzo[d]thiazole core of this compound imparts significant aromaticity and stability, further enhancing its utility in synthetic processes. Overall, 2-(4-(Bromomethyl)phenyl)-6-methoxybenzo[d]thiazole is a valuable tool for chemists seeking to design and synthesize novel organic compounds with diverse applications.