2,2,2-trifluoro-N-(4-phenylphenyl)acetamide

Base Information

• Chemical Name: 2,2,2-trifluoro-N-(4-phenylphenyl)acetamide
• CAS No.: 347-37-5
• Molecular Formula: C14H10F3NO
• Molecular Weight: 265.235
• NSC Number: 95123
• DSSTox Substance ID: DTXSID00956179
• Nikkaji Number: J609.998J
• Mol file: 347-37-5.mol

Synonyms:2,2,2-trifluoro-N-(4-phenylphenyl)acetamide;347-37-5;NSC95123;N-(biphenyl-4-yl)-2,2,2-trifluoroacetamide;N-(Biphenyl-4-yl)-2,2,2-trifluoro-acetamide;NCIOpen2_006441;N-([1,1'-Biphenyl]-4-yl)-2,2,2-trifluoroacetamide;SCHEMBL8755361;DTXSID00956179;NSC-95123;STK064889;AKOS000484861;N-Biphenyl-4-yl-2,2,2-trifluoro-acetamide;AN-329/09989021;SR-01000198836;N-[1,1'-biphenyl]-4-yl-2,2,2-trifluoroacetamide;SR-01000198836-1

Chemical Property of 2,2,2-trifluoro-N-(4-phenylphenyl)acetamide

Chemical Property:

• Vapor Pressure: 1.08E-05mmHg at 25°C
• Boiling Point: 370.8°C at 760 mmHg
• Flash Point: 178.1°C
• PSA: 29.10000
• Density: 1.298g/cm³
• LogP: 3.92740
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 265.07144843
• Heavy Atom Count: 19
• Complexity: 302

Purity/Quality:

99% ^*data from raw suppliers

N-4-biphenylyl-2,2,2-trifluoroacetamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 2,2,2-trifluoro-N-(4-phenylphenyl)acetamide

There total 10 articles about 2,2,2-trifluoro-N-(4-phenylphenyl)acetamide 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: 98.0%

2,2,2-trifluoroacetamide (354-38-1) + 4-bromo-1,1'-biphenyl (92-66-0) → 2,2,2-trifluoro-4'-phenylacetanilide (347-37-5)

Guidance literature:

With potassium carbonate; N,N`-dimethylethylenediamine; copper(l) iodide; In 1,4-dioxane; at 75 ℃;

DOI:10.1016/j.tetlet.2007.11.012

Reference yield: 96.0%

4-phenylalanine (92-67-1) + trifluoroacetic acid (76-05-1) → 2,2,2-trifluoro-4'-phenylacetanilide (347-37-5)

Guidance literature:

With bis(trichloromethyl) carbonate; triethylamine; In dichloromethane; at 20 ℃; for 0.25h;

DOI:10.2174/157017811797249317

Reference yield: 92.0%

N-(4-bromophenyl)-2,2,2-trifluoro-acetamide (24568-11-4) + phenylboronic acid (98-80-6) → 2,2,2-trifluoro-4'-phenylacetanilide (347-37-5)

Guidance literature:

With cesium fluoride; tetrakis(triphenylphosphine) palladium⁽⁰⁾; In 1,2-dimethoxyethane; for 2h; Heating;

DOI:10.1021/jo00099a049

upstream raw materials:

4-phenylalanine

trifluoroacetic anhydride

N-(4-bromophenyl)-2,2,2-trifluoro-acetamide

phenylboronic acid

Downstream raw materials:

C₂₁H₂₄N₂O₂

(1R,3S)-3-(6-dimethylamino-hexanoylamino)-cyclopentanecarboxylic acid N-biphenyl-4-yl-N-methyl-amide

(1R,3S)-3-(3-ethyl-ureido)-cyclopentanecarboxylic acid N-biphenyl-4-yl-N-methyl-amide

(1R,3S)-3-isobutyrylamino-cyclopentanecarboxylic acid N-biphenyl-4-yl-N-methyl-amide