tert-butyl 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrole-1-carboxylate


Chemical Name: tert-butyl 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrole-1-carboxylate
CAS Number: 935278-73-2
Product Number: AG003UJI(AGN-PC-0698XR)
Synonyms:
MDL No:
Molecular Formula: C15H24BNO4
Molecular Weight: 293.1664

Identification/Properties


Properties
BP:
381.3±34.0°C at 760 mmHg
Storage:
Inert atmosphere;-10 ℃;
Form:
Solid
Computed Properties
Molecular Weight:
293.17g/mol
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
293.18g/mol
Monoisotopic Mass:
293.18g/mol
Topological Polar Surface Area:
49.7A^2
Heavy Atom Count:
21
Formal Charge:
0
Complexity:
400
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



The tert-Butyl 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrole-1-carboxylate is a versatile compound commonly used in chemical synthesis. It serves as a key building block in the creation of various organic molecules due to its unique structural properties. This compound is particularly valuable in cross-coupling reactions, where it acts as a stable boron source, facilitating the formation of complex carbon-carbon bonds. Its tert-butyl group enhances the compound's stability and reactivity, making it an essential tool for the synthesis of pharmaceuticals, agrochemicals, and functional materials.