6-Iodo-5-methoxypyridine-2-carboxylic acid

Base Information

• Chemical Name: 6-Iodo-5-methoxypyridine-2-carboxylic acid
• CAS No.: 154497-83-3
• Molecular Formula: C7H6INO3
• Molecular Weight: 279.03191
• DSSTox Substance ID: DTXSID601268734
• Mol file: 154497-83-3.mol

Synonyms:6-Iodo-5-methoxypicolinic acid;154497-83-3;6-iodo-5-methoxypyridine-2-carboxylic acid;6-iodo-5-methoxy-2-pyridinecarboxylic acid;6-Iodo-5-methoxy-pyridine-2-carboxylic acid;AN-584/43294058;6-Iodo-5-methoxypicolinicacid;SCHEMBL8825399;RAGBMWMAUGDAJG-UHFFFAOYSA-N;DTXSID601268734;AKOS022188315;2-iodo-3-methoxy-pyridine-6-carboxylic acid;CS-0308400;EN300-118833;F83605

Chemical Property of 6-Iodo-5-methoxypyridine-2-carboxylic acid

Chemical Property:

• Boiling Point: 392.9±42.0 °C(Predicted)
• PKA: 3.56±0.10(Predicted)
• PSA: 59.42000
• Density: 1.975±0.06 g/cm3(Predicted)
• LogP: 1.39300
• Storage Temp.: 2-8°C
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 278.93924
• Heavy Atom Count: 12
• Complexity: 176

Purity/Quality:

95+% ^*data from raw suppliers

6-Iodo-5-methoxypicolinicacid 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(N=C(C=C1)C(=O)O)I

Technology Process of 6-Iodo-5-methoxypyridine-2-carboxylic acid

There total 3 articles about 6-Iodo-5-methoxypyridine-2-carboxylic 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:

2-iodo-3-methoxy-6-methylpyridine (154497-82-2) → 6-iodo-5-methoxypicolinic acid (154497-83-3)

Guidance literature:

With potassium permanganate; at 90 ℃; for 3h;

DOI:10.1016/S0960-894X(98)00375-8

Reference yield:

5-Hydroxy-2-methylpyridine (1121-78-4) → 6-iodo-5-methoxypicolinic acid (154497-83-3)

Guidance literature:

Multi-step reaction with 3 steps

1: 81 percent / I₂, aq. NaHCO₃ / tetrahydrofuran / 24 h

2: Cs₂CO₃ / dimethylformamide / 55 °C

3: aq. KMnO₄ / 3 h / 90 °C

With potassium permanganate; iodine; sodium hydrogencarbonate; caesium carbonate; In tetrahydrofuran; N,N-dimethyl-formamide;

DOI:10.1016/S0960-894X(98)00375-8

Reference yield:

2-iodo-6-methyl-3-pyridinol (23003-30-7) → 6-iodo-5-methoxypicolinic acid (154497-83-3)

Guidance literature:

Multi-step reaction with 2 steps

1: Cs₂CO₃ / dimethylformamide / 55 °C

2: aq. KMnO₄ / 3 h / 90 °C

With potassium permanganate; caesium carbonate; In N,N-dimethyl-formamide;

DOI:10.1016/S0960-894X(98)00375-8

upstream raw materials:

2-iodo-3-methoxy-6-methylpyridine

5-Hydroxy-2-methylpyridine

2-iodo-6-methyl-3-pyridinol

Downstream raw materials:

2-iodo-3-methoxypyridine-6-carboxylic acid methyl ester

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