4-[(1-Ethyl-2-methyl-1h-indol-3-yl)carbonyl]isophthalic acid

Base Information

• Chemical Name: 4-[(1-Ethyl-2-methyl-1h-indol-3-yl)carbonyl]isophthalic acid
• CAS No.: 67697-32-9
• Molecular Formula: C20H17NO5
• Molecular Weight: 351.35268
• European Community (EC) Number: 266-911-2
• UNII: 6E8B52VK4T
• DSSTox Substance ID: DTXSID1070569
• Nikkaji Number: J333.312D
• Wikidata: Q81997918

Synonyms:67697-32-9;4-[(1-ethyl-2-methyl-1h-indol-3-yl)carbonyl]isophthalic acid;EINECS 266-911-2;4-((1-Ethyl-2-methyl-1H-indol-3-yl)carbonyl)isophthalic acid;1,3-Benzenedicarboxylic acid, 4-((1-ethyl-2-methyl-1H-indol-3-yl)carbonyl)-;1,3-Benzenedicarboxylic acid, 4-[(1-ethyl-2-methyl-1H-indol-3-yl)carbonyl]-;2-((1-Ethyl-2-methylindol-3-yl)carbonyl)-1,5-benzenedicarboxylic acid;4-[(1-Ethyl-2-methyl-1H-indol-3-yl)carbonyl]-1,3-benzenedicarboxylic acid;6E8B52VK4T;DTXSID1070569;SCHEMBL11060511

Chemical Property of 4-[(1-Ethyl-2-methyl-1h-indol-3-yl)carbonyl]isophthalic acid

Chemical Property:

• Vapor Pressure: 1.63E-16mmHg at 25°C
• Boiling Point: 625.6°C at 760 mmHg
• Flash Point: 332.1°C
• PSA: 96.60000
• Density: 1.32g/cm³
• LogP: 3.59700
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 351.11067264
• Heavy Atom Count: 26
• Complexity: 577

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCN1C(=C(C2=CC=CC=C21)C(=O)C3=C(C=C(C=C3)C(=O)O)C(=O)O)C

Technology Process of 4-[(1-Ethyl-2-methyl-1h-indol-3-yl)carbonyl]isophthalic acid

There total 1 articles about 4-[(1-Ethyl-2-methyl-1h-indol-3-yl)carbonyl]isophthalic 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:

1-ethyl-2-methylindole (40876-94-6) + trimellitic anhydride → 5-carboxy-2-[(1-ethyl-2-methyl-3-indolyl)carbonyl]benzoic acid (67697-32-9)

Guidance literature:

In 1,2-dichloro-ethane;

upstream raw materials:

1-ethyl-2-methylindole

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