Methyl 6-phenylpyridine-2-carboxylate

Base Information

• Chemical Name: Methyl 6-phenylpyridine-2-carboxylate
• CAS No.: 206127-25-5
• Molecular Formula: C13H11NO2
• Molecular Weight: 213.236
• DSSTox Substance ID: DTXSID50456199
• Nikkaji Number: J956.093I
• Wikidata: Q82278447
• Mol file: 206127-25-5.mol

Synonyms:206127-25-5;methyl 6-phenylpicolinate;Methyl 6-phenylpyridine-2-carboxylate;6-Phenylpyridine-2-carboxylic acid methyl ester;METHYL-6-PHENYL-2-PYRIDINE CARBOXYLATE;methyl6-phenylpicolinate;SCHEMBL1260197;DTXSID50456199;SCLJKMDPGCDUNH-UHFFFAOYSA-N;BS-49137;CS-0160588;FT-0706110;METHYL-6-PHENYL-2-PYRIDINECARBOXYLATE;E75870;4-PENTENOIC ACID, 3-HYDROXY-4-METHYL-, METHYL ESTER

Chemical Property of Methyl 6-phenylpyridine-2-carboxylate

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 373.322oC at 760 mmHg
• Flash Point: 179.579oC
• PSA: 39.19000
• Density: 1.147g/cm3
• LogP: 2.53520
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 213.078978594
• Heavy Atom Count: 16
• Complexity: 236

Purity/Quality:

99% ^*data from raw suppliers

METHYL-6-PHENYL-2-PYRIDINE CARBOXYLATE 98.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: COC(=O)C1=CC=CC(=N1)C2=CC=CC=C2

Technology Process of Methyl 6-phenylpyridine-2-carboxylate

There total 9 articles about Methyl 6-phenylpyridine-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: 81.0%

methyl 6-(trifluoromethylsulfonyloxy)picolinate (1006364-83-5) + phenylboronic acid (98-80-6) → 6-phenylpyridine-2-carboxylic acid methyl ester (206127-25-5)

Guidance literature:

With tetrakis(triphenylphosphine) palladium⁽⁰⁾; sodium carbonate; In 1,4-dioxane; at 85 ℃; for 18h;

DOI:10.1016/j.tet.2009.07.076

Reference yield: 33.0%

1-azidostyrene (16717-64-9) + 1-hydroxy-cyclopropanecarboxylic acid methyl ester (33689-29-1) → 6-phenylpyridine-2-carboxylic acid methyl ester (206127-25-5)

Guidance literature:

1-azidostyrene; 1-hydroxy-cyclopropanecarboxylic acid methyl ester; With manganese(III) acetylacetonate; In methanol; at 20 ℃; for 0.0833333h; Inert atmosphere;

With acetic acid; In methanol; at 20 ℃; for 10h;

DOI:10.1021/ja905110c

Reference yield:

methyl 6-Bromopicolinate (26218-75-7) + phenylboronic acid (98-80-6) → 6-phenylpyridine-2-carboxylic acid methyl ester (206127-25-5)

Guidance literature:

With potassium carbonate; tetrakis(triphenylphosphine) palladium⁽⁰⁾; In methanol; hexane; ethyl acetate; toluene;

upstream raw materials:

diazomethane

6-phenyl-pyridine-2-carboxylic acid

tributylethynyltin

5-phenyl-1,2,4-triazine-3-carboxylic acid methyl ester

Downstream raw materials:

3-phenyl-6-amidopyridine

methyl(2-phenylpyridin-6-yl)-methanone

methyl 6-phenylpyridine-2-carboxylate 1-oxide

C₁₇H₂₀N₂O₃

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