Methyl 3-(trifluoroMethyl)isonicotinate

Base Information

• Chemical Name: Methyl 3-(trifluoroMethyl)isonicotinate
• CAS No.: 1203952-88-8
• Molecular Formula: C₈H₆F₃NO₂
• Molecular Weight: 205.136
• Hs Code.: 2933399990
• Mol file: 1203952-88-8.mol

Synonyms:Methyl 3-(trifluoroMethyl)isonicotinate;3-Trifluoromethyl-isonicotinic acid methyl ester

Chemical Property of Methyl 3-(trifluoroMethyl)isonicotinate

Chemical Property:

• PSA: 39.19000
• LogP: 1.88700

Purity/Quality:

98%min ^*data from raw suppliers

Methyl 3-(trifluoromethyl)isonicotinate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of Methyl 3-(trifluoroMethyl)isonicotinate

There total 4 articles about Methyl 3-(trifluoroMethyl)isonicotinate 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: 74.0%

(1,10-phenanthroline)(trifluoromethyl)copper (I) + methyl 3-bromoisonicotinate (59786-31-1) → methyl 3-(trifluoromethyl)isonicotinate (1203952-88-8)

Guidance literature:

In N,N-dimethyl-formamide; at 100 ℃; for 8h; Sealed tube; Inert atmosphere;

DOI:10.1021/ol500422t

Reference yield:

methanol (67-56-1) + 3-(trifluoromethyl)pyridine-4-carboxylic acid → methyl 3-(trifluoromethyl)isonicotinate (1203952-88-8)

Guidance literature:

thionyl chloride; for 15h; Reflux;

Reference yield:

methanol (67-56-1) + 3-(trifluoromethyl)isonicotinoyl chloride (1282541-17-6) → methyl 3-(trifluoromethyl)isonicotinate (1203952-88-8)

Guidance literature:

at 25 - 30 ℃; for 1h;

upstream raw materials:

methanol

methyl 3-bromoisonicotinate

3-(trifluoromethyl)isonicotinoyl chloride

Downstream raw materials:

(3-(trifluoromethyl)pyridin-4-yl)methanol

3-(trifluoromethyl)-4-pyridinecarboxaldehyde

Refernces

• 1、 Mormino, Michael G.,Fier, Patrick S.,Hartwig, John F.. "Copper-mediated perfluoroalkylation of heteroaryl bromides with (phen)CuRF". supporting information. p. 1744 - 1747. Retrieved 2014/04/17.