5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)pyrimidin-2-amine


Chemical Name: 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)pyrimidin-2-amine
CAS Number: 944401-58-5
Product Number: AG00H7IW(AGN-PC-0BSZAC)
Synonyms:
MDL No:
Molecular Formula: C11H15BF3N3O2
Molecular Weight: 289.0619

Identification/Properties


Properties
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
289.065g/mol
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
8
Rotatable Bond Count:
1
Exact Mass:
289.121g/mol
Monoisotopic Mass:
289.121g/mol
Topological Polar Surface Area:
70.3A^2
Heavy Atom Count:
20
Formal Charge:
0
Complexity:
362
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-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)pyrimidin-2-amine is a versatile reagent commonly employed in chemical synthesis for the functionalization of organic molecules. This compound serves as a valuable building block due to its unique structural features, which allow for selective and efficient modification of various chemical scaffolds. By incorporating this compound into synthetic pathways, chemists can introduce specific functional groups with precision, enabling the creation of complex molecular structures with desired properties. Additionally, the presence of boron and fluorine atoms in the molecule imparts distinct reactivity profiles, making it a valuable tool for the synthesis of pharmaceuticals, agrochemicals, and materials with tailored characteristics.