1,3,2-Dioxaborolane, 4,4,5,5-tetramethyl-2-[3-(1-methylethyl)phenyl]-


Chemical Name: 1,3,2-Dioxaborolane, 4,4,5,5-tetramethyl-2-[3-(1-methylethyl)phenyl]-
CAS Number: 325142-89-0
Product Number: AG003ETY(AGN-PC-03MNKR)
Synonyms:
MDL No:
Molecular Formula: C15H23BO2
Molecular Weight: 246.1529

Identification/Properties


Properties
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
246.157g/mol
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
246.179g/mol
Monoisotopic Mass:
246.179g/mol
Topological Polar Surface Area:
18.5A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
283
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:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



2-(3-Isopropylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane is a versatile compound that finds wide application in chemical synthesis. This compound is commonly used as a boronic ester in various organic reactions, particularly in palladium-catalyzed cross-coupling reactions such as Suzuki-Miyaura coupling and Heck reaction. Its unique structure containing boron and oxygen atoms makes it a valuable building block for constructing complex organic molecules with high efficiency and selectivity. In addition, the steric hindrance provided by the bulky tetramethyl groups around the boron center makes this compound particularly useful in controlling regioselectivity and improving yields in organic transformations.