Ethanimidoyl chloride, N-(2,6-dimethylphenyl)-2,2,2-trifluoro-

Base Information

• Chemical Name: Ethanimidoyl chloride, N-(2,6-dimethylphenyl)-2,2,2-trifluoro-
• CAS No.: 65158-40-9
• Molecular Formula: C10H9ClF3N
• Molecular Weight: 235.636
• DSSTox Substance ID: DTXSID10438951
• Nikkaji Number: J519.472E

Synonyms:Ethanimidoyl chloride, N-(2,6-dimethylphenyl)-2,2,2-trifluoro-;65158-40-9;SCHEMBL4574252;SCHEMBL4574254;DTXSID10438951;LHNZFDZUKYUEPW-UHFFFAOYSA-N;1-Chloro-2,2,2-trifluoro-N-(2,6-dimethylphenyl)ethanimine

Chemical Property of Ethanimidoyl chloride, N-(2,6-dimethylphenyl)-2,2,2-trifluoro-

Chemical Property:

• XLogP3: 4.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 235.0375615
• Heavy Atom Count: 15
• Complexity: 240

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(=CC=C1)C)N=C(C(F)(F)F)Cl

Technology Process of Ethanimidoyl chloride, N-(2,6-dimethylphenyl)-2,2,2-trifluoro-

There total 3 articles about Ethanimidoyl chloride, N-(2,6-dimethylphenyl)-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: 86.0%

2,6-dimethylaniline (87-62-7) + trifluoroacetic acid (76-05-1) → (Z)-N-(2,6-dimethylphenyl)-2,2,2-trifluoroacetimidoyl chloride (65158-40-9)

Guidance literature:

trifluoroacetic acid; With tetrachloromethane; triethylamine; triphenylphosphine; at 0 ℃; for 0.166667h; Inert atmosphere;

2,6-dimethylaniline; at 0 - 85 ℃; Inert atmosphere;

DOI:10.1021/acs.orglett.6b00795

Reference yield:

2,6-dimethylaniline (87-62-7) + trifluoroacetic acid (76-05-1) → N-(2,6-xylyl)-2,2,2-trifluoroacetimidoyl chloride (65158-40-9)

Guidance literature:

With tetrachloromethane; TEA; triphenylphosphine; Heating;

DOI:10.1016/S0040-4039(00)74253-5

Reference yield:

→ N-(2,6-xylyl)-2,2,2-trifluoroacetimidoyl chloride (65158-40-9)

Guidance literature:

N-(2.6-Dimethylphenyl)-trifluoracetamid, BCl3;

DOI:10.1007/BF00897683

upstream raw materials:

2,6-dimethylaniline

trifluoroacetic acid

Downstream raw materials:

(N-(2,6-dimethylphenyl)-2,2,2-trifluoroacetimidoyl)trimethylsilane

2-[(E)-2,6-Dimethyl-phenylimino]-3,3,3-trifluoro-propionic acid ethyl ester

N-(2,6-dimethylphenyl)-2,2,2-trifluoroethanimidic acid 1-methylethylidene hydrazide

N-(2,6-Dimethylphenyl)-2,2,2-trifluoroacetimidoyl iodide

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