5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,3-dihydroinden-1-one


Chemical Name: 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,3-dihydroinden-1-one
CAS Number: 214360-81-3
Product Number: AG0072D6(AGN-PC-01XOPF)
Synonyms:
MDL No:
Molecular Formula: C15H19BO3
Molecular Weight: 258.1206

Identification/Properties


Computed Properties
Molecular Weight:
258.124g/mol
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
258.143g/mol
Monoisotopic Mass:
258.143g/mol
Topological Polar Surface Area:
35.5A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
375
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

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Chemical Structure



The compound 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,3-dihydro-1H-inden-1-one plays a crucial role in chemical synthesis as a versatile building block. Its boron functionality makes it a valuable reagent for Suzuki-Miyaura cross-coupling reactions, enabling the formation of biaryl compounds. This compound can be utilized for the construction of complex organic molecules in medicinal chemistry, material science, and agrochemical research. Its unique structure allows for the selective modification of aromatic rings, making it an indispensable tool for the creation of diverse molecular structures with high precision and efficiency.