DIM-C-pPhCO2Me

Base Information

• Chemical Name: DIM-C-pPhCO2Me
• CAS No.: 151358-48-4
• Molecular Formula: C₂₅H₂₀N₂O₂
• Molecular Weight: 380.446
• DSSTox Substance ID: DTXSID801271204
• Nikkaji Number: J3.596.813J
• Mol file: 151358-48-4.mol

Synonyms:DIM-C-pPhCO2Me;p-carboxymethylphenyl 1,1-bis(3'-indolyl)-1-(p-carboxymethylphenyl)methane

Chemical Property of DIM-C-pPhCO2Me

Chemical Property:

• XLogP3: 5.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 380.152477885
• Heavy Atom Count: 29
• Complexity: 541

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: COC(=O)C1=CC=C(C=C1)C(C2=CNC3=CC=CC=C32)C4=CNC5=CC=CC=C54

Technology Process of DIM-C-pPhCO2Me

There total 2 articles about DIM-C-pPhCO2Me 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%

indole (120-72-9) + methyl 4-formylbenzoate (1571-08-0) → 1,1-bis(3'-indolyl)-1-(p-carbomethoxyphenyl)methane (151358-48-4)

Guidance literature:

In water; at 170 ℃; for 6h; Green chemistry;

DOI:10.1246/bcsj.20150247

Reference yield: 84.0%

indole (120-72-9) + methyl 4-((2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-yl)(1H-indol-3yl)methyl)benzoate → 1,1-bis(3'-indolyl)-1-(p-carbomethoxyphenyl)methane (151358-48-4)

Guidance literature:

With scandium tris(trifluoromethanesulfonate); In acetonitrile; at 50 ℃; for 3h; Inert atmosphere;

DOI:10.1021/jo4017524

Reference yield: 89.0%

1,1-bis(3'-indolyl)-1-(p-carbomethoxyphenyl)methane (151358-48-4) → bis(1H-indol-3-yl)(4-(methoxycarbonyl)phenyl)methylium chloride

Guidance literature:

With hydrogenchloride; dipyridinium dichromate; In methanol; at 20 ℃; for 1h;

DOI:10.1016/j.ejmech.2020.113020

upstream raw materials:

indole

methyl 4-formylbenzoate