2-Pyridinecarboxylic acid, 6-((5-chloro-2-((4-chloro-2-fluorophenyl)methoxy)phenyl)methyl)-

Base Information

Chemical Name:2-Pyridinecarboxylic acid, 6-((5-chloro-2-((4-chloro-2-fluorophenyl)methoxy)phenyl)methyl)-
CAS No.:892664-17-4
Molecular Formula:C₂₀H₁₄Cl₂FNO₃
Molecular Weight:406.24
Hs Code.:
UNII:CQ5912425U
ChEMBL ID:CHEMBL1207972
DSSTox Substance ID:DTXSID101031225
Nikkaji Number:J3.184.158E
Wikidata:Q27275647

Synonyms:GSK-269984B;892664-17-4;GSK-269984A free acid;GSK-269984 free acid;2-Pyridinecarboxylic acid, 6-((5-chloro-2-((4-chloro-2-fluorophenyl)methoxy)phenyl)methyl)-;UNII-CQ5912425U;CQ5912425U;6-((5-Chloro-2-(((4-chloro-2-fluorophenyl)methyl)oxy)phenyl)methyl)-2-pyridinecarboxylic acid;CHEMBL1207972;6-[[5-chloro-2-[(4-chloro-2-fluorophenyl)methoxy]phenyl]methyl]pyridine-2-carboxylic acid;6-[(5-chloro-2-{[(4-chloro-2-fluorophenyl)methyl]oxy}phenyl)methyl]-2-pyridinecarboxylic acid;SCHEMBL2953298;HJPAXYLYYQIFCK-UHFFFAOYSA-N;DTXSID101031225;BDBM50424394;AKOS040748469;HY-121594;CS-0082805;Q27275647;6-(5-Chloro-2-((4-chloro-2-fluorobenzyl)oxy)benzyl)pyridine-2-carboxylic acid;6-[(5-chloro-2-{[(4-chloro-2-fluorophenyl)methyl]oxy}phenyl)-methyl]-2-pyridinecarboxylic acid;6-[(5-Chloro-2-{[(4-chloro-2-fluorophenyl)methyl]oxy}phenyl)methyl]- 2-pyridinecarboxylic acid

Suppliers and Price of 2-Pyridinecarboxylic acid, 6-((5-chloro-2-((4-chloro-2-fluorophenyl)methoxy)phenyl)methyl)-

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 2-Pyridinecarboxylic acid, 6-((5-chloro-2-((4-chloro-2-fluorophenyl)methoxy)phenyl)methyl)-

Chemical Property:

XLogP3:5.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:405.0334769
Heavy Atom Count:27
Complexity:498

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC(=NC(=C1)C(=O)O)CC2=C(C=CC(=C2)Cl)OCC3=C(C=C(C=C3)Cl)F

Technology Process of 2-Pyridinecarboxylic acid, 6-((5-chloro-2-((4-chloro-2-fluorophenyl)methoxy)phenyl)methyl)-

There total 18 articles about 2-Pyridinecarboxylic acid, 6-((5-chloro-2-((4-chloro-2-fluorophenyl)methoxy)phenyl)methyl)- 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: 68.0%

: sodium 6-[(5-chloro-2-{[(4-chloro-2-fluorophenyl)methyl]oxy}phenyl)methyl]-2-pyridinecarboxylate

: 892664-17-4
6-[(5-chloro-2-{[(4-chloro-2-fluorophenyl)methyl]oxy}phenyl)methyl]-2-pyridinecarboxylic acid

Guidance literature:: With acetic acid; In toluene;
DOI:10.1016/j.bmcl.2012.11.046

Reference yield:

: 892663-09-1
ethyl 6-[(5-chloro-2-{[(4-chloro-2-fluorophenyl)methyl]oxy}phenyl)methyl]-2-pyridinecarboxylate

: 892664-17-4
6-[(5-chloro-2-{[(4-chloro-2-fluorophenyl)methyl]oxy}phenyl)methyl]-2-pyridinecarboxylic acid

Guidance literature:: ethyl 6-[(5-chloro-2-{[(4-chloro-2-fluorophenyl)methyl]oxy}phenyl)methyl]-2-pyridinecarboxylate; With water; In ethanol; for 5h; Reflux;

With formic acid; In ethanol; water; at 65 - 78 ℃;
DOI:10.1021/op100072y

Reference yield:

: 21908-10-1
ethyl 6-formyl-2-pyridinecarboxylate

: 892664-17-4
6-[(5-chloro-2-{[(4-chloro-2-fluorophenyl)methyl]oxy}phenyl)methyl]-2-pyridinecarboxylic acid

Guidance literature:: Multi-step reaction with 5 steps

1.1: ethylmagnesium bromide / dichloromethane; tert-butyl methyl ether / 0 - 23 °C

1.2: 2 h / 20 °C

2.1: palladium 10% on activated carbon; sulfuric acid; hydrogen; zinc dibromide / ethyl acetate / 6 h / 65 °C / 1520.1 Torr

3.1: potassium carbonate / ethanol / 2 h / Reflux

4.1: water; sodium hydroxide / ethanol / 70 - 82 °C / Large scale reaction

5.1: water; acetic acid / toluene / 60 - 70 °C

With sulfuric acid; palladium 10% on activated carbon; ethylmagnesium bromide; water; hydrogen; potassium carbonate; acetic acid; sodium hydroxide; zinc dibromide; In ethanol; dichloromethane; tert-butyl methyl ether; ethyl acetate; toluene;
DOI:10.1021/op100072y