(4'-Acetyl-[1,1'-biphenyl]-4-yl)boronic acid

Base Information

• Chemical Name: (4'-Acetyl-[1,1'-biphenyl]-4-yl)boronic acid
• CAS No.: 1029438-14-9
• Molecular Formula: C14H13BO3
• Molecular Weight: 240.066
• Hs Code.: 2931900090
• DSSTox Substance ID: DTXSID10681602
• Nikkaji Number: J1.669.613G
• Wikidata: Q82605697
• Mol file: 1029438-14-9.mol

Synonyms:1029438-14-9;(4'-Acetyl-[1,1'-biphenyl]-4-yl)boronic acid;4'-ACETYLBIPHENYL-4-BORONIC ACID;[4-(4-acetylphenyl)phenyl]boronic acid;{4'-acetyl-[1,1'-biphenyl]-4-yl}boronic acid;(4'-Acetyl-[1,1'-biphenyl]-4-yl)boronicacid;SCHEMBL257776;DTXSID10681602;MFCD16295057;(4'-Acetyl-4-biphenylyl)boronic acid;AKOS015837766;BS-25255;CS-0174687;E84425;(4'-Acetyl[1,1'-biphenyl]-4-yl)boronic acid;A896673

Chemical Property of (4'-Acetyl-[1,1'-biphenyl]-4-yl)boronic acid

Chemical Property:

• Boiling Point: 441.5±47.0 °C(Predicted)
• PKA: 8.46±0.17(Predicted)
• PSA: 57.53000
• Density: 1.22±0.1 g/cm3(Predicted)
• LogP: 1.23600
• Storage Temp.: Room temperature.
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 240.0957744
• Heavy Atom Count: 18
• Complexity: 277

Purity/Quality:

≥95% ^*data from raw suppliers

4''-Acetylbiphenyl-4-boronicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: B(C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)C)(O)O

Technology Process of (4'-Acetyl-[1,1'-biphenyl]-4-yl)boronic acid

There total 1 articles about (4'-Acetyl-[1,1'-biphenyl]-4-yl)boronic acid which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 47.0%

→ 4'-acetyl-biphenyl boronic acid (1029438-14-9)

Guidance literature:

With potassium carbonate; In ethanol; water; at 50 ℃; for 5h; Inert atmosphere;

Reference yield: 18.0%

4'-acetyl-biphenyl boronic acid (1029438-14-9) + (4R,5R,6S)-4-methyl-3,7-dioxo-6-((1'R)-triethylsilanyloxy-ethyl)-1-aza-bicyclo[3.2.0]heptane-2-carboxylic acid 4-nitro-benzyl-ester (186817-91-4) → (4S,5R,6S)-3-(4'-acetyl-biphenyl-4-yl)-4-methyl-7-oxo-6-((1'R)-triethylsilanyloxy-ethyl)-1-aza-bicyclo[3.2.0]hept-2-ene-2-carboxylic acid 4-nitro-benzyl-ester

Guidance literature:

(4R,5R,6S)-4-methyl-3,7-dioxo-6-((1'R)-triethylsilanyloxy-ethyl)-1-aza-bicyclo[3.2.0]heptane-2-carboxylic acid 4-nitro-benzyl-ester; With triethylamine; In dichloromethane; for 0.25h; Inert atmosphere;

With trifluoromethylsulfonic anhydride; In dichloromethane; at -78 ℃; for 0.5h;

4'-acetyl-biphenyl boronic acid; With potassium hydroxide; bis(dibenzylideneacetone)-palladium⁽⁰⁾; In tetrahydrofuran; dichloromethane; water; at 20 ℃;

Reference yield:

4'-acetyl-biphenyl boronic acid (1029438-14-9) + 4-nitrobenzyl (1R,5R,6S)-1-methyl-6-[(1R)-triethylsilanyloxy-ethyl]-2-(trifluoro-methanesulfonyloxy)-carbapen-2-em-3-carboxylate (165817-82-3) → (4S,5R,6S)-3-(4'-acetyl-biphenyl-4-yl)-4-methyl-7-oxo-6-((1'R)-triethylsilanyloxy-ethyl)-1-aza-bicyclo[3.2.0]hept-2-ene-2-carboxylic acid 4-nitro-benzyl-ester (1354627-15-8)

Guidance literature:

With potassium hydroxide; bis(dibenzylideneacetone)-palladium⁽⁰⁾; In tetrahydrofuran; dichloromethane; water; at -78 - 20 ℃; Inert atmosphere;

Downstream raw materials:

(4S,5R,6S)-3-(4'-acetyl-biphenyl-4-yl)-4-methyl-7-oxo-6-((1'R)-triethylsilanyloxy-ethyl)-1-aza-bicyclo[3.2.0]hept-2-ene-2-carboxylic acid 4-nitro-benzyl-ester

Refernces

• 1、 -. "INHIBITORS OF FATTY ACID AMIDE HYDROLASE". Page/Page column 172. . Retrieved 2008/12/05.