N-(4-acetylphenyl)-2,2,2-trifluoroacetamide

Base Information

• Chemical Name: N-(4-acetylphenyl)-2,2,2-trifluoroacetamide
• CAS No.: 24568-13-6
• Molecular Formula: C10H8 F3 N O2
• Molecular Weight: 231.174
• Hs Code.: 2924299090
• NSC Number: 103788
• DSSTox Substance ID: DTXSID80179304
• Nikkaji Number: J2.541.905G
• Wikidata: Q83049815
• Mol file: 24568-13-6.mol

Synonyms:N-(4-acetylphenyl)-2,2,2-trifluoroacetamide;24568-13-6;NSC 103788;ACETANILIDE, 4'-ACETYL-2,2,2-TRIFLUORO-;4'-Acetyl-2,2,2-trifluoroacetanilide;BRN 2374913;N-(4-Acetyl-phenyl)-2,2,2-trifluoro-acetamide;Acetamide, N-(4-acetylphenyl)-2,2,2-trifluoro-;NSC103788;SCHEMBL7428282;DTXSID80179304;MFCD00780957;STK013557;AKOS000485395;NSC-103788;LS-01221;CS-0309344;EN300-176793;AG-219/36619010;BRD-K67849647-001-01-2;Z56968128

Chemical Property of N-(4-acetylphenyl)-2,2,2-trifluoroacetamide

Chemical Property:

• Vapor Pressure: 0.000144mmHg at 25°C
• Boiling Point: 332.7°Cat760mmHg
• Flash Point: 155°C
• PSA: 46.17000
• Density: 1.356g/cm³
• LogP: 2.46300
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 231.05071298
• Heavy Atom Count: 16
• Complexity: 280

Purity/Quality:

98%min ^*data from raw suppliers

N-(4-Acetylphenyl)-2,2,2-trifluoroacetamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of N-(4-acetylphenyl)-2,2,2-trifluoroacetamide

There total 7 articles about N-(4-acetylphenyl)-2,2,2-trifluoroacetamide 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: 99.0%

p-aminobenzophenone (99-92-3) + trifluoroacetic anhydride (407-25-0) → N-(4-acetylphenyl)-2,2,2-trifluoroacetamide (24568-13-6)

Guidance literature:

With triethylamine; In dichloromethane; at 10 ℃;

Reference yield: 90.0%

2,2,2-trifluoroacetamide (354-38-1) + 4-Iodoacetophenone (13329-40-3) → N-(4-acetylphenyl)-2,2,2-trifluoroacetamide (24568-13-6)

Guidance literature:

With potassium phosphate; N,N`-dimethylethylenediamine; copper(l) iodide; In N,N-dimethyl-formamide; at 45 ℃;

DOI:10.1016/j.tetlet.2007.11.012

Reference yield: 81.0%

2,2,2-trifluoroacetamide (354-38-1) + para-bromoacetophenone (99-90-1) → N-(4-acetylphenyl)-2,2,2-trifluoroacetamide (24568-13-6)

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

upstream raw materials:

p-aminobenzophenone

trifluoroacetic anhydride

2,2,2-trifluoro-N-phenylacetamide

acetic anhydride

Downstream raw materials:

N-[4-(1-cyano-1-hydroxyethyl)phenyl]-2,2,2-trifluoroacetamide

Oxo-[4-(2,2,2-trifluoro-acetylamino)-phenyl]-acetic acid ethyl ester

N-{4-[4-(2,2,2-Trifluoro-acetylamino)-phenyl]-thiazol-2-yl}-oxalamic acid ethyl ester

rac-N-{4-[2-(tert-butylamino)-1-hydroxyethyl]phenyl}-2-chloroacetamide