Methyl 6-oxo-1,6-dihydropyridine-2-carboxylate

Base Information

• Chemical Name: Methyl 6-oxo-1,6-dihydropyridine-2-carboxylate
• CAS No.: 30062-34-1
• Molecular Formula: C7H7NO3
• Molecular Weight: 153.137
• Hs Code.: 2933399090
• European Community (EC) Number: 829-181-1
• DSSTox Substance ID: DTXSID80492222
• Nikkaji Number: J496.408J
• Wikidata: Q82337905
• Mol file: 30062-34-1.mol

Synonyms:Methyl 6-oxo-1,6-dihydropyridine-2-carboxylate;30062-34-1;methyl 6-hydroxypicolinate;methyl 6-hydroxypyridine-2-carboxylate;METHYL 6-OXO-1H-PYRIDINE-2-CARBOXYLATE;MFCD17015470;methyl 6-hydroxy-2-pyridinecarboxylate;2-Pyridinecarboxylic acid, 1,6-dihydro-6-oxo-, methyl ester;methyl-6-hydroxypicolinate;Methyl6-oxo-1,6-dihydropyridine-2-carboxylate;SCHEMBL987483;AMY9334;DTXSID80492222;GJLWQAUHCDNAEK-UHFFFAOYSA-N;6-Hydroxypicolinic acid methyl ester;AKOS016005952;CS-W005400;methyl 6-hydroxypicolinate hydrochloride;DS-15614;SY043112;EN300-208557;I12009;6-Hydroxypyridine-2-carboxylic acid methyl ester;6-hydroxy-pyridine-2-carboxylic acid methyl ester;A876320;Methyl 6-hydroxypyridine-2-carboxylate, AldrichCPR;Methyl 6-oxo-1 pound not6-dihydropyridine-2-carboxylate;Z1255426352;6-oxo-1,6-dihydro-pyridine-2-carboxylic acid methyl ester;6-Oxo-1,6-dihydropyridine-2-carboxylic acid methyl ester

Chemical Property of Methyl 6-oxo-1,6-dihydropyridine-2-carboxylate

Chemical Property:

• Vapor Pressure: 1.41E-05mmHg at 25°C
• Melting Point: 109-110 °C
• Boiling Point: 356.6oC at 760 mmHg
• PKA: 8.83±0.10(Predicted)
• Flash Point: 169.5oC
• PSA: 59.42000
• Density: 1.287g/cm3
• LogP: 0.57380
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 0.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 153.042593085
• Heavy Atom Count: 11
• Complexity: 252

Purity/Quality:

97% ^*data from raw suppliers

Methyl6-Oxo-1,6-dihydropyridine-2-carboxylate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)C1=CC=CC(=O)N1

Technology Process of Methyl 6-oxo-1,6-dihydropyridine-2-carboxylate

There total 9 articles about Methyl 6-oxo-1,6-dihydropyridine-2-carboxylate 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: 100.0%

methanol (67-56-1) + 2-oxo-1,2-dihydropyridine-6-carboxylic acid (19621-92-2) → methyl 6-oxo-1,6-dihydropyridine-2-carboxylate (30062-34-1)

Guidance literature:

With thionyl chloride; at 20 ℃; for 24h; Cooling with ice;

Reference yield: 96.0%

methyl 1-(benzyloxy)-6-oxo-1,2,3,6-tetrahydropyridine-2-carboxylate (1006364-82-4) → methyl 6-oxo-1,6-dihydropyridine-2-carboxylate (30062-34-1)

Guidance literature:

With 1,8-diazabicyclo[5.4.0]undec-7-ene; In tetrahydrofuran; at 20 ℃; for 1.75h; Inert atmosphere;

DOI:10.1055/s-2008-1067180

Reference yield: 90.0%

methanol (67-56-1) + 6-Hydroxypicolinic acid (19621-92-2) → methyl 6-hydroxypyridine-2-carboxylate (30062-34-1)

Guidance literature:

With thionyl chloride; for 14h; Heating / reflux;

upstream raw materials:

6-Hydroxypicolinic acid

methanol

1-oxy-pyridine-2-carboxylic acid methyl ester

2-oxo-1,2-dihydropyridine-6-carboxylic acid

Downstream raw materials:

6-hydroxy-pyridine-2-carboxylic acid amide

methyl 6-chloropicolinate

methyl 1-(4-chlorobenzyl)-6-oxo-1,6-dihydropyridine-2-carboxylate

methyl 6-[(4-chlorobenzyl)oxy]pyridine-2-carboxylate