3-Benzoylpicolinic acid

Base Information

• Chemical Name: 3-Benzoylpicolinic acid
• CAS No.: 64362-32-9
• Molecular Formula: C13H9NO3
• Molecular Weight: 227.219
• European Community (EC) Number: 624-144-4
• DSSTox Substance ID: DTXSID40352454
• Nikkaji Number: J1.908.623B
• Wikidata: Q72440487
• Mol file: 64362-32-9.mol

Synonyms:3-Benzoylpicolinic acid;64362-32-9;3-Benzoylpyridine-2-carboxylic acid;3-Benzoyl-2-pyridinecarboxylic acid;3-Benzoylpicolinicacid;3-Benzoyl-pyridine-2-carboxylic acid;beta-Benzoylpicolinsaure;Maybridge3_000526;2-Carboxy-3-benzoylpyridine;Oprea1_551417;AC-907/30063051;SCHEMBL296670;benzoyl-pyridine-carboxylic acid;DTXSID40352454;YERHKEWRHQIXFY-UHFFFAOYSA-N;HMS1432H20;3-benzoylpyridin-2-carboxylic acid;CCG-47095;MFCD00209545;3-benzoyl pyridine-2-carboxylic acid;IDI1_011913;AS-36389;3-Benzoylpyridine-2-carboxylic acid, 98%;CS-0171245;FT-0615091;2-pyridinecarboxylic acid,3-benzoyl-,hydrochloride;SR-01000636742-1

Chemical Property of 3-Benzoylpicolinic acid

Chemical Property:

• Vapor Pressure: 1.58E-09mmHg at 25°C
• Melting Point: 151-155 °C(lit.)
• Refractive Index: 1.622
• Boiling Point: 467.1 °C at 760 mmHg
• Flash Point: 236.3 °C
• PSA: 67.26000
• Density: 1.311 g/cm³
• LogP: 2.01080
• Storage Temp.: 2-8°C
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 227.058243149
• Heavy Atom Count: 17
• Complexity: 297

Purity/Quality:

97% ^*data from raw suppliers

3-BenzoylpicolinicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C(=O)C2=C(N=CC=C2)C(=O)O
• Uses: 3-Benzoylpyridine-2-carboxylic acid may be used in the synthesis of 5-methyl-N-aryl substituted-1,3-oxazolidine-2,4-dione derivatives.

Technology Process of 3-Benzoylpicolinic acid

There total 11 articles about 3-Benzoylpicolinic 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: 95.0%

1-Hydroxy-2-methyl-1-phenyl-pyrro<3,4-b>pyridine-3(1H)-one (78140-38-2) → 3-benzoylpyridine-2-carboxylic acid (64362-32-9)

Guidance literature:

With sulfuric acid; for 0.75h; Heating;

DOI:10.1007/BF00808955

Reference yield: 95.0%

3-hydroxy-2,3-diphenyl-7-azaisoindolinone (104728-70-3) → 3-benzoylpyridine-2-carboxylic acid (64362-32-9)

Guidance literature:

With sulfuric acid; for 0.75h; Heating;

DOI:10.1007/BF00808955

Reference yield: 23.0%

→ 3-benzoylpyridine-2-carboxylic acid (64362-32-9)

Guidance literature:

upstream raw materials:

2-methyl-3-benzylpyridine

1-Hydroxy-2-methyl-1-phenyl-pyrro<3,4-b>pyridine-3(1H)-one

3-hydroxy-2,3-diphenyl-7-azaisoindolinone

Pyridine-2,3-dicarboxylic anhydride

Downstream raw materials:

3-Benzoylpyridine

5,7-Diphenylpyrido<2,3-d>pyridazin-8(7H)-one

3-Benzoyl-methylpicolinate

2-amino-3-benzoylpyridine