Ethyl 6-chloropicolinate

Base Information

• Chemical Name: Ethyl 6-chloropicolinate
• CAS No.: 21190-89-6
• Molecular Formula: C8H8ClNO2
• Molecular Weight: 185.6076
• Hs Code.: 2933399090
• European Community (EC) Number: 800-914-7
• DSSTox Substance ID: DTXSID90453804
• Nikkaji Number: J1.093.082K
• Wikidata: Q72473768
• Mol file: 21190-89-6.mol

Synonyms:Ethyl 6-chloropicolinate;21190-89-6;Ethyl 6-chloropyridine-2-carboxylate;ethyl 6-CHLORO-2-PYRIDINECARBOXYLATE;6-chloropyridine-2-carboxylic acid ethyl ester;2-Pyridinecarboxylic acid, 6-chloro-, ethyl ester;MFCD09878438;Ethyl6-chloropicolinate;6-Chloro-pyridine-2-carboxylic acid ethyl ester;2-Pyridinecarboxylicacid, 6-chloro-, ethyl ester;SCHEMBL1095857;DTXSID90453804;ORSVWYSFUABOQU-UHFFFAOYSA-N;2-Chloro-6-ethoxycarbonyl-pyridine;Ethyl 2-chloro-6-pyridinecarboxylate;AKOS011693448;CS-W016933;GS-3794;SB52254;SY039716;FT-0696116;EN300-124196;A879209;J-521192;Z987238224;6-Chloropyridine-2-carboxylic acid ethyl ester;Ethyl 6-Chloropyridine-2-carboxylate

Chemical Property of Ethyl 6-chloropicolinate

Chemical Property:

• Vapor Pressure: 0.002mmHg at 25°C
• Refractive Index: 1.525
• Boiling Point: 289.317 °C at 760 mmHg
• PKA: -0.89±0.10(Predicted)
• Flash Point: 128.775 °C
• PSA: 39.19000
• Density: 1.246 g/cm³
• LogP: 1.91170
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 185.0243562
• Heavy Atom Count: 12
• Complexity: 163

Purity/Quality:

97%min ^*data from raw suppliers

Ethyl6-Chloropicolinate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1=NC(=CC=C1)Cl

Technology Process of Ethyl 6-chloropicolinate

There total 4 articles about Ethyl 6-chloropicolinate 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: 94.0%

6-chloropicolinic acid (4684-94-0) + ethanol (64-17-5) → 6-chloropyridine-2-carboxylic acid ethyl ester (21190-89-6)

Guidance literature:

6-chloropicolinic acid; ethanol; With sulfuric acid; In toluene; for 3h; Reflux;

With potassium carbonate; In water; ethyl acetate;

Reference yield:

2,6-dichloropyridine (2402-78-0) + ethanol (64-17-5) + carbon monoxide (201230-82-2) → diethyl-2,6-pyridinedicarbonyl ester (15658-60-3) + 6-chloropyridine-2-carboxylic acid ethyl ester (21190-89-6)

Guidance literature:

With triethylamine; triphenylphosphine; bis-triphenylphosphine-palladium(II) chloride; In toluene; at 140 ℃; for 16h; under 37503 Torr;

DOI:10.1016/S0040-4039(99)00597-3

Reference yield:

6-chloropicolinic acid (4684-94-0) → 6-chloropyridine-2-carboxylic acid ethyl ester (21190-89-6)

Guidance literature:

With hydrogenchloride; In ethanol; ethyl acetate;

upstream raw materials:

2,6-dichloropyridine

ethanol

carbon monoxide

6-chloropicolinic acid

Downstream raw materials:

ethyl 6-(2-(3-(biphenyl-4-yl)-1-(tert-butyldimethylsilyloxy)propyl)oxazol-5-yl)pyridine-2-carboxylate

methyl 6-(2-(1-(tert-butyldimethylsilyloxy)-3-(4'-((triethylsilyloxy)methyl)biphenyl-4-yl)propyl)oxazol-5-yl)pyridine-2-carboxylate

(6-isopropyl-2-pyridyl)methanol

ethyl 6-vinylpicolinate

Refernces

• 1、 Riflade, Benoit,Lachkar, David,Oble, Julie,Li, Joaquim,Thorimbert, Serge,Hasenknopf, Bernold,Lacote, Emmanuel. "Pd-containing organopolyoxometalates derived from Dawson polyoxometalate [P2W15V3O62]9-: Lewis acidity and dual site catalysis". supporting information. p. 3860 - 3863. Retrieved 2014/08/18.
• 2、 -. "Phenoxylpropanolamines, method for the production thereof and pharmaceutical compositions containing the same". . . Retrieved 2008/06/13.