5-Pyrimidinecarboxylic acid, 4-(4-cyanophenyl)-1,2,3,4-tetrahydro-6-methyl-2-oxo-1-[3-(trifluorometh yl)phenyl]-

Base Information

• Chemical Name: 5-Pyrimidinecarboxylic acid, 4-(4-cyanophenyl)-1,2,3,4-tetrahydro-6-methyl-2-oxo-1-[3-(trifluorometh yl)phenyl]-
• CAS No.: 671775-95-4
• Molecular Formula: C20H14F3N3O3
• Molecular Weight: 401.345
• Mol file: 671775-95-4.mol

Synonyms:

Chemical Property of 5-Pyrimidinecarboxylic acid, 4-(4-cyanophenyl)-1,2,3,4-tetrahydro-6-methyl-2-oxo-1-[3-(trifluorometh yl)phenyl]-

Chemical Property:

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 5-Pyrimidinecarboxylic acid, 4-(4-cyanophenyl)-1,2,3,4-tetrahydro-6-methyl-2-oxo-1-[3-(trifluorometh yl)phenyl]-

There total 7 articles about 5-Pyrimidinecarboxylic acid, 4-(4-cyanophenyl)-1,2,3,4-tetrahydro-6-methyl-2-oxo-1-[3-(trifluorometh yl)phenyl]- 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: 52.0%

allyl 4-(4-cyanophenyl)-6-methyl-2-oxo-1-[3-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydro-pyrimidine-5-carboxylate (864151-32-6) → 4-(4-cyanophenyl)-6-methyl-2-oxo-1-[3-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylic acid (671775-95-4)

Guidance literature:

allyl 4-(4-cyanophenyl)-6-methyl-2-oxo-1-[3-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydro-pyrimidine-5-carboxylate; With morpholine; tetrakis(triphenylphosphine) palladium⁽⁰⁾; In tetrahydrofuran; at 20 ℃; for 0.25h;

With hydrogenchloride; water; In ethyl acetate; Product distribution / selectivity;

Reference yield: 45.0%

potassium hydroxide (1310-58-3) + ethyl (rac)-4-(4-cyanophenyl)-6-methyl-2-oxo-1-[3-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate (675103-26-1,671775-85-2) → 4-(4-cyanophenyl)-6-methyl-2-oxo-1-[3-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylic acid (671775-95-4)

Guidance literature:

In ethanol; water; at 20 ℃; for 18h; Alkaline aqueous solution;

Reference yield: 45.0%

ethyl (rac)-4-(4-cyanophenyl)-6-methyl-2-oxo-1-[3-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate (675103-26-1,671775-85-2) → 4-(4-cyanophenyl)-6-methyl-2-oxo-1-[3-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylic acid (671775-95-4)

Guidance literature:

With potassium hydroxide; ethanol; water; at 20 ℃; for 18h; Product distribution / selectivity;

upstream raw materials:

potassium hydroxide

ethyl (rac)-4-(4-cyanophenyl)-6-methyl-2-oxo-1-[3-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate

allyl 4-(4-cyanophenyl)-6-methyl-2-oxo-1-[3-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydro-pyrimidine-5-carboxylate

C₂₇H₂₀F₃N₃O₃

Downstream raw materials:

4-{5-(1H-imidazol-1-ylcarbonyl)-6-methyl-2-oxo-1-[3-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydro-4-pyrimidinyl}benzonitrile

(4R)-4-(4-cyanophenyl)-6-methyl-2-oxo-1-[3-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylic acid

2-(3-pyridinyl)ethyl 4-(4-cyanophenyl)-6-methyl-2-oxo-1-[3-(trifluoromethyl)-phenyl]-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate

2-(2-pyridinyl)methyl 4-(4-cyanophenyl)-6-methyl-2-oxo-1-[3-(trifluoromethyl)-phenyl]-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate

Refernces

• 1、 -. "MULTIMERS OF HETEROCYCLIC COMPOUNDS AND THEIR USE". Page/Page column 49. . Retrieved 2008/06/13.
• 2、 -. "HETEROCYCLIC DERIVATIVES". Page/Page column 34-35. . Retrieved 2010/02/13.