Acetamide, N,N'-(1,2-ethynediyldi-2,1-phenylene)bis[2,2,2-trifluoro-

Base Information

• Chemical Name: Acetamide, N,N'-(1,2-ethynediyldi-2,1-phenylene)bis[2,2,2-trifluoro-
• CAS No.: 397314-26-0
• Molecular Formula: C18H10F6N2O2
• Molecular Weight: 400.28
• DSSTox Substance ID: DTXSID00458562
• Nikkaji Number: J1.748.066I
• Mol file: 397314-26-0.mol

Synonyms:Acetamide, N,N'-(1,2-ethynediyldi-2,1-phenylene)bis[2,2,2-trifluoro-;397314-26-0;DTXSID00458562;VEZAPUAQHDAMBN-UHFFFAOYSA-N;N,N'-[Ethyne-1,2-diylbis(o-phenylene)]bis(trifluoroacetamide)

Chemical Property of Acetamide, N,N'-(1,2-ethynediyldi-2,1-phenylene)bis[2,2,2-trifluoro-

Chemical Property:

• XLogP3: 4.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 4
• Exact Mass: 400.06464654
• Heavy Atom Count: 28
• Complexity: 594

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)C#CC2=CC=CC=C2NC(=O)C(F)(F)F)NC(=O)C(F)(F)F

Technology Process of Acetamide, N,N'-(1,2-ethynediyldi-2,1-phenylene)bis[2,2,2-trifluoro-

There total 1 articles about Acetamide, N,N'-(1,2-ethynediyldi-2,1-phenylene)bis[2,2,2-trifluoro- 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: 100.0%

trifluoroacetic anhydride (407-25-0) + N-{2-[(2-aminophenyl)ethynyl]phenyl}-2,2,2-trifluoroacetamide (228575-98-2) → bis(o-trifluoroacetamidophenyl)acetylene (397314-26-0)

Guidance literature:

In tetrahydrofuran; at 20 ℃; for 2h;

DOI:10.1055/s-2001-17458 DOI:10.1021/ol0256769

Reference yield: 97.0%

4-Iodoacetophenone (13329-40-3) + bis(o-trifluoroacetamidophenyl)acetylene (397314-26-0) → 1-[4-(6-trifluoromethyl-indolo[1,2-c]quinazolin-12-yl)-phenyl]-ethanone

Guidance literature:

With potassium carbonate; tetrakis(triphenylphosphine) palladium⁽⁰⁾; In dimethyl sulfoxide; at 50 ℃; for 2h;

DOI:10.1055/s-2001-17458

Reference yield: 92.0%

para-iodoanisole (696-62-8) + bis(o-trifluoroacetamidophenyl)acetylene (397314-26-0) → 12-(4-methoxy-phenyl)-6-trifluoromethyl-indolo[1,2-c]quinazoline

Guidance literature:

With potassium carbonate; tetrakis(triphenylphosphine) palladium⁽⁰⁾; In dimethyl sulfoxide; at 50 ℃; for 1.5h;

DOI:10.1055/s-2001-17458

upstream raw materials:

trifluoroacetic anhydride

N-{2-[(2-aminophenyl)ethynyl]phenyl}-2,2,2-trifluoroacetamide