5-Chloro-2-(trifluoromethyl)nicotinic acid

Base Information

Chemical Name:5-Chloro-2-(trifluoromethyl)nicotinic acid
CAS No.:823222-02-2
Molecular Formula:C₇H₃ClF₃NO₂
Molecular Weight:225.555
Hs Code.:
DSSTox Substance ID:DTXSID40694245
Nikkaji Number:J2.126.249H
Wikidata:Q82623276
Mol file:823222-02-2.mol

Synonyms:5-Chloro-2-(trifluoromethyl)nicotinic acid;823222-02-2;5-CHLORO-2-(TRIFLUOROMETHYL)PYRIDINE-3-CARBOXYLIC ACID;3-Pyridinecarboxylic acid, 5-chloro-2-(trifluoromethyl)-;SCHEMBL23119566;DTXSID40694245;SWAUZBSMIIDEMA-UHFFFAOYSA-N;AKOS024263020;AB62441;5-Chloro-2-(trifluoromethyl)nicotinicacid;5-Chloro-2-trifluoromethyl-nicotinic acid;E80451;2-(Trifluoromethyl)-5-chloropyridine-3-carboxylic acid

Suppliers and Price of 5-Chloro-2-(trifluoromethyl)nicotinic acid

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Crysdot
5-Chloro-2-(trifluoromethyl)nicotinicacid 95+%
5g
$ 1705.00

Crysdot
5-Chloro-2-(trifluoromethyl)nicotinicacid 95+%
1g
$ 641.00

American Custom Chemicals Corporation
5-CHLORO-2-(TRIFLUOROMETHYL)NICOTINIC ACID 95.00%
5MG
$ 497.16

Alichem
5-Chloro-2-(trifluoromethyl)nicotinicacid
5g
$ 2057.52

Alichem
5-Chloro-2-(trifluoromethyl)nicotinicacid
1g
$ 776.74

Total 10 raw suppliers

Chemical Property of 5-Chloro-2-(trifluoromethyl)nicotinic acid

Chemical Property:

XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:1
Exact Mass:224.9804405
Heavy Atom Count:14
Complexity:234

Purity/Quality:

97% ^*data from raw suppliers

5-Chloro-2-(trifluoromethyl)nicotinicacid 95+% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=C(C=NC(=C1C(=O)O)C(F)(F)F)Cl

Technology Process of 5-Chloro-2-(trifluoromethyl)nicotinic acid

There total 4 articles about 5-Chloro-2-(trifluoromethyl)nicotinic acid 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: 84.0%

: 81290-20-2
(trifluoromethyl)trimethylsilane

: 823222-22-6
3-bromo-5-chloro-2-(trifluoromethyl)pyridine

: 823222-02-2
5-chloro-2-(trifluoromethyl)pyridine-3-carboxylic acid

Guidance literature:: With 1-methyl-pyrrolidin-2-one; potassium fluoride; copper(l) iodide; Heating;
DOI:10.1016/j.tet.2004.09.106

Reference yield:

: 26163-03-1
2-amino-3-bromo-5-chloropyridine

: 823222-02-2
5-chloro-2-(trifluoromethyl)pyridine-3-carboxylic acid

Guidance literature:: Multi-step reaction with 4 steps

1: hydrobromic acid; bromine; sodium nitrite / H₂O / -5 - 60 °C

2: 9.7 g / sodium iodide; chlorotrimethylsilane / various solvent(s) / 0.75 h / Heating

3: 69 percent / potassium fluoride; cuprous iodide; N-methylpyrrolidinone / Heating

4: 84 percent / potassium fluoride; cuprous iodide; N-methylpyrrolidinon / Heating

With 1-methyl-pyrrolidin-2-one; potassium fluoride; copper(l) iodide; chloro-trimethyl-silane; hydrogen bromide; bromine; sodium iodide; sodium nitrite; In water;
DOI:10.1016/j.tet.2004.09.106

Reference yield:

: 137628-17-2
2,3-dibromo-5-chloro-pyridine

: 823222-02-2
5-chloro-2-(trifluoromethyl)pyridine-3-carboxylic acid

Guidance literature:: Multi-step reaction with 3 steps

1: 9.7 g / sodium iodide; chlorotrimethylsilane / various solvent(s) / 0.75 h / Heating

2: 69 percent / potassium fluoride; cuprous iodide; N-methylpyrrolidinone / Heating

3: 84 percent / potassium fluoride; cuprous iodide; N-methylpyrrolidinon / Heating

With 1-methyl-pyrrolidin-2-one; potassium fluoride; copper(l) iodide; chloro-trimethyl-silane; sodium iodide; In various solvent(s);
DOI:10.1016/j.tet.2004.09.106