4-[[3-Chloro-4-[2-[2-(3,4-dimethylphenoxy)ethoxy]ethoxy]-5-methoxyphenyl]methylidene]-2-phenyl-1,3-oxazol-5-one

Base Information

• Chemical Name: 4-[[3-Chloro-4-[2-[2-(3,4-dimethylphenoxy)ethoxy]ethoxy]-5-methoxyphenyl]methylidene]-2-phenyl-1,3-oxazol-5-one
• CAS No.: 5826-29-9
• Molecular Formula: C₁₀H₁₂O₅
• Molecular Weight: 212.202
• DSSTox Substance ID: DTXSID10411284

Synonyms:5826-29-9;AC1NQKOF;DTXSID10411284

Chemical Property of 4-[[3-Chloro-4-[2-[2-(3,4-dimethylphenoxy)ethoxy]ethoxy]-5-methoxyphenyl]methylidene]-2-phenyl-1,3-oxazol-5-one

Chemical Property:

• Vapor Pressure: 9.51E-18mmHg at 25°C
• Boiling Point: 668.7°Cat760mmHg
• Flash Point: 358.2°C
• Density: 1.22g/cm³
• XLogP3: 6.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 11
• Exact Mass: 521.1605153
• Heavy Atom Count: 37
• Complexity: 797

Purity/Quality:

98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=C(C=C1)OCCOCCOC2=C(C=C(C=C2Cl)C=C3C(=O)OC(=N3)C4=CC=CC=C4)OC)C

Technology Process of 4-[[3-Chloro-4-[2-[2-(3,4-dimethylphenoxy)ethoxy]ethoxy]-5-methoxyphenyl]methylidene]-2-phenyl-1,3-oxazol-5-one

There total 9 articles about 4-[[3-Chloro-4-[2-[2-(3,4-dimethylphenoxy)ethoxy]ethoxy]-5-methoxyphenyl]methylidene]-2-phenyl-1,3-oxazol-5-one 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: 92.0%

endo-bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic dimethyl ester (39589-98-5) → 3-carbomethoxy-5-hydroxy-2,6-norbornanecarbolactone (61849-18-1,73036-38-1,86259-10-1,119238-45-8,119238-46-9,5826-29-9)

Guidance literature:

With dihydrogen peroxide; poly(N-isopropylacrylamide)-based phosphotungstate complex; In water; at 60 ℃; for 6h;

DOI:10.1002/adsc.200700114

Reference yield: 85.0%

Peroxyformic acid (107-32-4) + (1R,2S,3S,4S)-bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid (70190-87-3) → (1R,2R,3R,6S,7S,9S)-2-Hydroxy-5-oxo-4-oxa-tricyclo[4.2.1.03,7]nonane-9-carboxylic acid methyl ester (5826-29-9,61849-18-1,73036-38-1,86259-10-1,119238-45-8,119238-46-9)

Guidance literature:

DOI:10.1016/S0040-4039(01)80062-9

Reference yield:

diazomethane (186581-53-3,908094-01-9,334-88-3) → 3-carbomethoxy-5-hydroxy-2,6-norbornanecarbolactone (61849-18-1,73036-38-1,86259-10-1,119238-45-8,119238-46-9,5826-29-9)

Guidance literature:

With diethyl ether;

DOI:10.1021/ja01549a058

upstream raw materials:

diazomethane

methanol

exo-2,3-Epoxybicyclo[2.2.1]heptane endo,endo-5,6-dicarboxylic anhydride

3,6-endomethylene-1,2,3,6-tetrahydrophthalic anhydride

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