5-Hydroxy-4-(methoxycarbonyl)nicotinic acid

Base Information

• Chemical Name: 5-Hydroxy-4-(methoxycarbonyl)nicotinic acid
• CAS No.: 243980-03-2
• Molecular Formula: C₈H₇NO₅
• Molecular Weight: 197.147
• Hs Code.: 2933399090
• DSSTox Substance ID: DTXSID20376259
• Wikidata: Q82165147
• Mol file: 243980-03-2.mol

Synonyms:243980-03-2;5-Hydroxy-4-(methoxycarbonyl)nicotinic acid;5-hydroxy-4-methoxycarbonylpyridine-3-carboxylic acid;5-Hydroxypyridine-3,4-dicarboxylic acid methyl ester;5-Hydroxy-3,4-pyridinedicarboxylic acid 4-methyl ester;DTXSID20376259;FT-0620470

Chemical Property of 5-Hydroxy-4-(methoxycarbonyl)nicotinic acid

Chemical Property:

• Vapor Pressure: 7.12E-10mmHg at 25°C
• Refractive Index: 1.598
• Boiling Point: 476.2 °C at 760 mmHg
• Flash Point: 241.8 °C
• PSA: 96.72000
• Density: 1.499 g/cm³
• LogP: 0.27200
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 197.03242232
• Heavy Atom Count: 14
• Complexity: 242

Purity/Quality:

99% ^*data from raw suppliers

5-Hydroxy-4-(methoxycarbonyl)nicotinicacid 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)C1=C(C=NC=C1C(=O)O)O

Technology Process of 5-Hydroxy-4-(methoxycarbonyl)nicotinic acid

There total 1 articles about 5-Hydroxy-4-(methoxycarbonyl)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: 96.0%

5-hydroxypyridine-3,4-dicarboxylic acid dimethyl ester (19804-07-0) → 5-hydroxypyridine-3,4-dicarboxylic acid 4-methyl ester (243980-03-2)

Guidance literature:

With sodium hydroxide; In water; at 25 ℃; for 2h;

DOI:10.3891/acta.chem.scand.53-0521

upstream raw materials:

5-hydroxypyridine-3,4-dicarboxylic acid dimethyl ester

Refernces