methyl 2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate


Chemical Name: methyl 2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate
CAS Number: 334018-52-9
Product Number: AG00C0CC(AGN-PC-03S442)
Synonyms:
MDL No:
Molecular Formula: C14H18BClO4
Molecular Weight: 296.5543

Identification/Properties


Properties
MP:
48-51 °C
BP:
387.704°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
296.554g/mol
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
296.099g/mol
Monoisotopic Mass:
296.099g/mol
Topological Polar Surface Area:
44.8A^2
Heavy Atom Count:
20
Formal Charge:
0
Complexity:
369
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


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Chemical Structure



Methyl 2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate is a versatile compound commonly used in chemical synthesis. This compound serves as a valuable building block in the production of various organic materials and pharmaceuticals. Its unique structure allows for precise control over the attachment of functional groups, making it ideal for creating complex molecules with specific properties. In organic synthesis, Methyl 2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate is frequently employed as a key reagent for introducing the 2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid moiety into target molecules. This compound's reactivity and stability make it a valuable tool for chemists working on the development of new materials, drug compounds, and other advanced chemical products.