Ethyl 2,6-difluorobenzene-1-carboximidate

Base Information

• Chemical Name: Ethyl 2,6-difluorobenzene-1-carboximidate
• CAS No.: 74237-17-5
• Molecular Formula: C9H9F2NO
• Molecular Weight: 185.173
• DSSTox Substance ID: DTXSID40547828
• Wikidata: Q82426311

Synonyms:Ethyl 2,6-difluorobenzene-1-carboximidate;74237-17-5;ethyl 2,6-difluorobenzimidate;ETHYL 2,6-DIFLUOROBENZENECARBOXIMIDATE;SCHEMBL8299666;DTXSID40547828;AAEAROPSJVBKTF-UHFFFAOYSA-N;AKOS006311681;F94424

Chemical Property of Ethyl 2,6-difluorobenzene-1-carboximidate

Chemical Property:

• XLogP3: 2.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 185.06522023
• Heavy Atom Count: 13
• Complexity: 177

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=N)C1=C(C=CC=C1F)F

Technology Process of Ethyl 2,6-difluorobenzene-1-carboximidate

There total 2 articles about Ethyl 2,6-difluorobenzene-1-carboximidate 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:

2,6-difluorobenzamide (18063-03-1) → ethyl-2,6-difluoro benzimidate (74237-17-5)

Guidance literature:

With triethyloxonium fluoroborate; In dichloromethane;

Reference yield:

2,6-difluorobenzamide (18063-03-1) + triethyloxonium fluoroborate (368-39-8) → ethyl-2,6-difluoro benzimidate (74237-17-5)

Guidance literature:

In dichloromethane; chloroform;

Reference yield: 25.8%

2-chloronicotinoyl chloride + ethyl-2,6-difluoro benzimidate (74237-17-5) + methylhydrazine (60-34-4) → 5-(2-chloropyridin-3-yl)-3-(2,6-difluorophenyl)-1-methyl-1H-1, 2,4-triazole (152169-93-2)

Guidance literature:

With triethylamine; In toluene;

upstream raw materials:

2,6-difluorobenzamide

triethyloxonium fluoroborate

Downstream raw materials:

5-(2-chloropyridin-3-yl)-3-(2,6-difluorophenyl)-1-methyl-1H-1, 2,4-triazole

5-[3-chloro-4-(4-trifluoromethylbenzyloxy)phenyl]3-(2,6-difluorophenyl)-1-methyl-1H-1,2,4-triazole

5-[3-chloro-4-(4-trifluoromethoxybenzyloxy)phenyl]3-(2,6-difluorophenyl)-1-methyl-1H-1,2,4-triazole

2-(4-nitrophenoxy)-3-chloro-5-trifluoromethyl pyridine

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