[U-Ring-13C6]-2-(4-Ethylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Product Name [U-Ring-13C6]-2-(4-Ethylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAT No. CS-EK-02513
CAS No. 1075719-87-7 unlabeled
Category Stable Isotopes
Stock Enquire
Mol. Wt. Not Available
Mol. For. Not Available
Hazardous This is not a Hazardous Compound
COA View Sample COA
MSDS View Sample MSDS
Canonical Smiles B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)CC
InchIKey RWANCHDMVNWYHW-UHFFFAOYSA-N
Inchl InChI=1S/C14H21BO2/c1-6-11-7-9-12(10-8-11)15-16-13(2,3)14(4,5)17-15/h7-10H,6H2,1-5H3
IUPAC 2-(4-ethylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Controlled No
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[U-Ring-13C6]-2-(4-Ethylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane, also known as 13C6-labeled ethylphenyl boronic ester, is a chemical compound that is widely used in organic synthesis, medicinal chemistry, and materials science. It is a boronic ester derivative that contains a boron atom attached to two methyl groups, two aryl groups, and an oxygen atom. The compound is labeled with 13C6, which means that six carbon atoms in the molecule are replaced with the stable isotope of carbon. The primary usage of [U-Ring-13C6]-2-(4-Ethylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane is as a reagent in organic synthesis, particularly in the synthesis of biologically active compounds such as pharmaceuticals, agrochemicals, and natural products. It is also used in the preparation of functional materials such as polymers, dyes, and catalysts. The labeled compound is often used in nuclear magnetic resonance (NMR) spectroscopy to study the structure, dynamics, and interactions of molecules in solution. The chemical information of [U-Ring-13C6]-2-(4-Ethylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane includes its molecular formula, C16H23BClO2, and its molecular weight, 308.64 g/mol. The boronic ester group in the molecule has a high affinity for diols, which makes it a useful tool for the recognition and sensing of carbohydrates and other biomolecules. The labeled carbon atoms in the compound allow for precise determination of the structure and reaction pathways of organic molecules, which is particularly important in drug discovery and development. Overall, [U-Ring-13C6]-2-(4-Ethylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane is a versatile and valuable reagent for chemical research and development.

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