4-ACETYLPHENYLBORONIC ACID, PINACOL ESTER

Product Information

Molecular Formula:
C14H19BO3
Molecular Weight:
246.11
Description
4-ACETYLPHENYLBORONIC ACID, PINACOL ESTER is a key intermediate in biomedicine and used for the synthesis of novel pharmaceutical agents. It plays a vital role in developing drugs for the treatment of various diseases such as cancer, diabetes, and inflammatory disorders. With its unique chemical structure, this compound exhibits potent therapeutic potential and serves as a valuable tool for biomedical research in the quest for new treatment options.
Synonyms
1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethanone; 1-(4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)ethanone; 4-Acetylphenylboronic acid, pinacol ester; 4-Acetylphenylboronic acid pinacol ester; (4-ACETYLPHENYL)BORONIC ACID PINACOL ESTER; 1-[4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethan-1-one; 1-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethan-1-one; 4-(4,4,5,5-Tetramethyl-[1,3,2]dioxaborolan-2yl)phenyl-ethanone; 4-(4,4,5,5-Tetramethyl-[1,3,2]dioxaborolan-2yl)phenylethanone; 2-(4-ACETYLPHENYL)-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE; 1-[4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethanone
IUPAC Name
1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethanone
Canonical SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)C(=O)C
InChI
InChI=1S/C14H19BO3/c1-10(16)11-6-8-12(9-7-11)15-17-13(2,3)14(4,5)18-15/h6-9H,1-5H3
InChI Key
BATKIZWNRQGSKE-UHFFFAOYSA-N
Flash Point
Not applicable

Computed Properties

Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
2
Exact Mass
246.1427246 g/mol
Monoisotopic Mass
246.1427246 g/mol
Topological Polar Surface Area
35.5Ų
Heavy Atom Count
18
Formal Charge
0
Complexity
314
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

Patents

Publication Number Title Priority Date
CN-113956274-A Design and synthesis method of fluorescent probe capable of responding to viscosity and peroxynitrite change in epileptic diseases 2021-10-29
KR-102274449-B1 Fluoranthene compound and organic light emitting element comprising the same 2019-11-05
KR-20210054300-A Fluoranthene compound and organic light emitting element comprising the same 2019-11-05
TW-202016109-A Pyrrolo[2,3-B]pyridine or pyrrolo[2,3-B]pyrazine as an HPK1 inhibitor and uses thereof 2018-06-13
CN-112004816-A PRC2 inhibitors 2018-01-31
KR-20200115570-A PRC2 inhibitor 2018-01-31
BR-112020015583-A2 compound, pharmaceutical composition, and, methods to inhibit the activity of prc2 in a cell and to treat cancer 2018-01-31
US-2021032252-A1 PRC2 Inhibitors 2018-01-31
US-2021101904-A1 Prc2 inhibitors 2018-01-31
IL-276156-A PRC2 drives 2018-01-31
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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