1H-Isoindole-1,3(2H)-dione,2-[[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl]-


Chemical Name: 1H-Isoindole-1,3(2H)-dione,2-[[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl]-
CAS Number: 138500-87-5
Product Number: AG0019BO(AGN-PC-0PMUI3)
Synonyms:
MDL No:
Molecular Formula: C21H22BNO4
Molecular Weight: 363.2147

Identification/Properties


Properties
MP:
155-158
BP:
504°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
363.22g/mol
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
363.164g/mol
Monoisotopic Mass:
363.164g/mol
Topological Polar Surface Area:
55.8A^2
Heavy Atom Count:
27
Formal Charge:
0
Complexity:
571
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#:
-
Hazard Statements:
H302-H312-H332
Precautionary Statements:
P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-P501
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



2-(4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzyl)isoindoline-1,3-dione is a versatile compound widely used in organic chemical synthesis. Its unique structure allows for selective functionalization and cross-coupling reactions, making it a valuable building block in the creation of complex molecules. This compound is particularly useful in Suzuki-Miyaura coupling reactions, where the boron moiety enables efficient carbon-carbon bond formation. Additionally, its isoindoline-1,3-dione scaffold serves as a valuable synthetic intermediate for the construction of biologically active compounds and pharmaceuticals.