2-[(5-Methyl-2-furoyl)amino]benzoic acid

Base Information

• Chemical Name: 2-[(5-Methyl-2-furoyl)amino]benzoic acid
• CAS No.: 423729-45-7
• Molecular Formula: C₁₃H₁₁NO₄
• Molecular Weight: 245.235
• DSSTox Substance ID: DTXSID60358099
• Wikidata: Q82138397
• Mol file: 423729-45-7.mol

Synonyms:423729-45-7;2-[(5-METHYL-2-FUROYL)AMINO]BENZOIC ACID;2-[(5-methylfuran-2-carbonyl)amino]benzoic Acid;2-(5-Methylfuran-2-carboxamido)benzoic acid;CHEMBRDG-BB 5923387;Cambridge id 5923387;Oprea1_568954;DTXSID60358099;MFCD00298104;AKOS005873837;BS-37666;2-(5-Methylfuran-2-carboxamido)benzoicacid;CS-0364690;SR-01000223406;SR-01000223406-1

Chemical Property of 2-[(5-Methyl-2-furoyl)amino]benzoic acid

Chemical Property:

• Vapor Pressure: 2.62E-05mmHg at 25°C
• Boiling Point: 343.8°C at 760 mmHg
• Flash Point: 161.7°C
• Density: 1.363g/cm³
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 245.06880783
• Heavy Atom Count: 18
• Complexity: 331

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(O1)C(=O)NC2=CC=CC=C2C(=O)O

Technology Process of 2-[(5-Methyl-2-furoyl)amino]benzoic acid

There total 1 articles about 2-[(5-Methyl-2-furoyl)amino]benzoic 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:

5-methylfuran-2-carbonyl chloride (14003-11-3) + anthranilic acid (118-92-3,159201-01-1,50816-84-7,80206-34-4,104809-47-4) → N-(5-methyl-furan-2-carbonyl)-anthranilic acid (423729-45-7)

Guidance literature:

With sodium carbonate; benzene;

Reference yield:

N-(5-methyl-furan-2-carbonyl)-anthranilic acid (423729-45-7) + aniline (62-53-3) → 2-(5-methylfuran-2-yl)-3-phenylquinazolin-4(3H)-one (101936-35-0)

Guidance literature:

With phosphorus trichloride;

Reference yield:

N-(5-methyl-furan-2-carbonyl)-anthranilic acid (423729-45-7) + aniline (62-53-3) + toluene (108-88-3,15644-74-3,16713-13-6) + phosphorus trichloride (7719-12-2,52843-90-0) → 2-(5-methylfuran-2-yl)-3-phenylquinazolin-4(3H)-one (101936-35-0)

Guidance literature:

upstream raw materials:

5-methylfuran-2-carbonyl chloride

anthranilic acid

Downstream raw materials:

2-(5-methylfuran-2-yl)-3-phenylquinazolin-4(3H)-one

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