Methyl 6-methoxy-5-nitronicotinate

Base Information

• Chemical Name: Methyl 6-methoxy-5-nitronicotinate
• CAS No.: 59237-49-9
• Molecular Formula: C8H8N2O5
• Molecular Weight: 212.16
• Hs Code.: 2933399090
• DSSTox Substance ID: DTXSID50372623
• Wikidata: Q82160430
• Mol file: 59237-49-9.mol

Synonyms:methyl 6-methoxy-5-nitronicotinate;59237-49-9;methyl 6-methoxy-5-nitropyridine-3-carboxylate;Methyl6-methoxy-5-nitronicotinate;SCHEMBL72187;DTXSID50372623;YVGHVJUGJZGYPW-UHFFFAOYSA-N;CCG-54596;MFCD02090529;AKOS016011951;AM807451;CS-16378;CS-0096415;A851453;SR-01000643685-1

Chemical Property of Methyl 6-methoxy-5-nitronicotinate

Chemical Property:

• Boiling Point: 331.0±37.0 °C(Predicted)
• PKA: -2.67±0.20(Predicted)
• PSA: 94.24000
• Density: 1.356±0.06 g/cm3(Predicted)
• LogP: 1.30820
• Storage Temp.: 2-8°C
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 212.04332136
• Heavy Atom Count: 15
• Complexity: 252

Purity/Quality:

98%Min ^*data from raw suppliers

Methyl6-methoxy-5-nitronicotinate 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=C(C=N1)C(=O)OC)[N+](=O)[O-]

Technology Process of Methyl 6-methoxy-5-nitronicotinate

There total 5 articles about Methyl 6-methoxy-5-nitronicotinate 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: 95.0%

methyl 6-chloro-5-nitro-pyridine-3-carboxylate (59237-53-5) + sodium methylate (124-41-4) → 6-methoxy-5-nitro-nicotinic acid methyl ester (59237-49-9)

Guidance literature:

In methanol;

Reference yield:

methyl 6-chloro-5-nitro-pyridine-3-carboxylate (59237-53-5) → 6-methoxy-5-nitro-nicotinic acid methyl ester (59237-49-9)

Guidance literature:

With sodium methylate; In methanol; water;

Reference yield:

methyl 6-chloro-5-nitro-pyridine-3-carboxylate (59237-53-5) → methyl 6-(methylthio)-5-nitronicotinate (166742-22-9) + 6-methoxy-5-nitro-nicotinic acid methyl ester (59237-49-9)

Guidance literature:

With sodium methylate; In methanol; water; sodium thiomethoxide;

upstream raw materials:

methyl 6-chloro-5-nitro-pyridine-3-carboxylate

sodium methylate

6-hydroxy-5-nitronicotinic acid

Downstream raw materials:

6-methoxy-5-nitronicotinaldehyde

methyl 5-amino-6-(methylthio)nicotinate

methyl 5-amino-6-methoxy-nicotinate

Refernces

• 1、 -. "PYRIDIN-2 (1H) -ONE DERIVATIVES USEFUL AS MEDICAMENTS FOR THE TREATMENT OF MYELOPROLIFERATIVE DISORDERS, TRANSPLANT REJECTION, IMMUNE-MEDIATED AND INFLAMMATORY DISEASES". Page/Page column 69. . Retrieved 2012/12/13.
• 2、 -. "SUBSTITUTED AROMATIC COMPOUNDS AS c.AMP PHOSPHODIESTERASE- AND TNF-INHIBITORS". . . Retrieved 2008/06/13.