6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-4H-1,4-benzoxazin-3-one


Chemical Name: 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-4H-1,4-benzoxazin-3-one
CAS Number: 943994-02-3
Product Number: AG00H7KT(AGN-PC-07ZRUH)
Synonyms:
MDL No:
Molecular Formula: C14H18BNO4
Molecular Weight: 275.1080

Identification/Properties


Properties
BP:
441.1°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
275.111g/mol
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
275.133g/mol
Monoisotopic Mass:
275.133g/mol
Topological Polar Surface Area:
56.8A^2
Heavy Atom Count:
20
Formal Charge:
0
Complexity:
396
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



6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-2H-benzo[b][1,4]oxazin-3(4H)-one is a versatile compound that finds common application in chemical synthesis as a key building block for the preparation of various organic molecules. Specifically, this compound serves as a valuable precursor in Suzuki-Miyaura cross-coupling reactions, a widely used method in organic chemistry for the formation of carbon-carbon bonds.By incorporating 6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-2H-benzo[b][1,4]oxazin-3(4H)-one into synthetic pathways, chemists can efficiently introduce functional groups or structural motifs into target molecules with high precision and control. This compound's unique structure imparts reactivity and selectivity, making it an essential tool for the strategic assembly of complex organic molecules in medicinal chemistry, material science, and other research areas that require the synthesis of diverse molecular architectures.