Methyl 2-chloro-6-methoxyisonicotinate

Base Information

• Chemical Name: Methyl 2-chloro-6-methoxyisonicotinate
• CAS No.: 42521-10-8
• Molecular Formula: C8H8ClNO3
• Molecular Weight: 201.609
• Hs Code.: 2933399090
• European Community (EC) Number: 670-264-5
• DSSTox Substance ID: DTXSID00537402
• Wikidata: Q72489267
• Mol file: 42521-10-8.mol

Synonyms:methyl 2-chloro-6-methoxyisonicotinate;42521-10-8;methyl 2-chloro-6-methoxypyridine-4-carboxylate;2-CHLORO-6-METHOXY-ISONICOTINICACIDMETHYLESTER;MFCD00173929;methyl (2-chloro-6-methoxypyridin-4-yl)carboxylate;SCHEMBL567975;AMY9325;DTXSID00537402;DAPAXVAUEVRBGS-UHFFFAOYSA-N;3-HYDROXY-2-METHOXYFLAVONE;CL0091;Methyl2-chloro-6-methoxyisonicotinate;AKOS005072979;methyl-2-chloro-6-methoxyisonicotinate;AB04382;HA-0921;AC-23235;SY028550;CS-0172564;2-Chloro-6-methoxy-isonicotinic acid methyl ester;A872867;AS-813/43501700;J-521991;2-CHLORO-6-METHOXYPYRIDINE-4-CARBOXYLIC ACID METHYL ESTER

Chemical Property of Methyl 2-chloro-6-methoxyisonicotinate

Chemical Property:

• Vapor Pressure: 0.00353mmHg at 25°C
• Melting Point: 97.5°
• Refractive Index: 1.521
• Boiling Point: 281.6 °C at 760 mmHg
• Flash Point: 124.1 °C
• PSA: 48.42000
• Density: 1.288 g/cm³
• LogP: 1.53020
• XLogP3: 2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 201.0192708
• Heavy Atom Count: 13
• Complexity: 188

Purity/Quality:

97% ^*data from raw suppliers

Methyl2-Chloro-6-methoxyisonicotinate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=NC(=CC(=C1)C(=O)OC)Cl

Technology Process of Methyl 2-chloro-6-methoxyisonicotinate

There total 9 articles about Methyl 2-chloro-6-methoxyisonicotinate 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: 94.7%

methyl 2,6-dichloroisonicotinate (42521-09-5) → 2-chloro-6-methoxyisonicotinic acid methyl ester (42521-10-8)

Guidance literature:

With hydrogenchloride; In methanol; water;

Reference yield: 90.0%

methyl 2,6-dichloroisonicotinate (42521-09-5) + sodium methylate (124-41-4) → 2-chloro-6-methoxyisonicotinic acid methyl ester (42521-10-8)

Guidance literature:

In methanol; for 3.5h; Reflux;

DOI:10.1021/acs.oprd.6b00210

Reference yield: 89.0%

methanol (67-56-1) + 2-chloro-6-methoxy-isonicotinic acid (15855-06-8) → 2-chloro-6-methoxyisonicotinic acid methyl ester (42521-10-8)

Guidance literature:

With sulfuric acid;

DOI:10.1021/acs.oprd.6b00210

upstream raw materials:

methyl 2,6-dichloroisonicotinate

sodium methylate

2-chloro-6-methoxy-isonicotinic acid

methyl iodide

Downstream raw materials:

methyl 2-methoxyisonicotinate

2-isobutyl-6-methoxy-isonicotinic acid methyl ester

2-methoxy-isonicotinic acid

2-methoxy-isonicotinic acid hydrazide