[1,1'-Biphenyl]-2-carboxylic acid, 4'-(bromomethyl)-, 1,1-dimethylethylester


Chemical Name: [1,1'-Biphenyl]-2-carboxylic acid, 4'-(bromomethyl)-, 1,1-dimethylethylester
CAS Number: 114772-40-6
Product Number: AG003UK3(AGN-PC-0P6QOJ)
Synonyms:
MDL No:
Molecular Formula: C18H19BrO2
Molecular Weight: 347.2463

Identification/Properties


Properties
MP:
98 - 101 °C
BP:
437°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Solubility:
Soluble in chloroform, ethyl acetate, and DMSO.
Computed Properties
Molecular Weight:
347.252g/mol
XLogP3:
4.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
5
Exact Mass:
346.057g/mol
Monoisotopic Mass:
346.057g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
21
Formal Charge:
0
Complexity:
340
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



2-Boc-4'-(Bromomethyl)biphenyl is a versatile compound widely utilized in chemical synthesis processes. This compound serves as a valuable building block in the creation of various complex organic molecules due to its unique structural properties and reactivity. In chemical synthesis, 2-Boc-4'-(Bromomethyl)biphenyl is commonly employed as a key intermediate in the synthesis of pharmaceuticals, agrochemicals, and materials science. Its bromomethyl group enables selective functionalization reactions, allowing chemists to introduce specific functionalities at desired positions within a molecule. This precise control over chemical transformations makes 2-Boc-4'-(Bromomethyl)biphenyl a crucial component in the creation of intricate molecular structures with high efficiency and purity. Additionally, the use of this compound in chemical synthesis facilitates the development of novel compounds with potentially valuable properties for various industrial applications.