2-[6-(2-Chlorobenzoyl)-3,4-dimethoxycyclohexa-2,4-dien-1-yl]-1-(4-methoxyphenyl)ethanone

Base Information

Chemical Name:2-[6-(2-Chlorobenzoyl)-3,4-dimethoxycyclohexa-2,4-dien-1-yl]-1-(4-methoxyphenyl)ethanone
CAS No.:5613-32-1
Molecular Formula:C24H23ClO5
Molecular Weight:290.101
Hs Code.:
DSSTox Substance ID:DTXSID30386228

Synonyms:CBMicro_036437;5613-32-1;2-[6-(2-chlorobenzoyl)-3,4-dimethoxycyclohexa-2,4-dien-1-yl]-1-(4-methoxyphenyl)ethanone;Cambridge id 5613321;Oprea1_085667;DTXSID30386228;2-[6-(2-chlorobenzoyl)-3,4-dimethoxy-1-cyclohexa-2,4-dienyl]-1-(4-methoxyphenyl)ethanone;BIM-0036313.P001;AB00090509-01

Suppliers and Price of 2-[6-(2-Chlorobenzoyl)-3,4-dimethoxycyclohexa-2,4-dien-1-yl]-1-(4-methoxyphenyl)ethanone

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

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Total 1 raw suppliers

Chemical Property of 2-[6-(2-Chlorobenzoyl)-3,4-dimethoxycyclohexa-2,4-dien-1-yl]-1-(4-methoxyphenyl)ethanone

Chemical Property:

Vapor Pressure:8.61E-15mmHg at 25°C
Boiling Point:609.4°Cat760mmHg
Flash Point:214.5°C
Density:1.26g/cm³
XLogP3:4.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:8
Exact Mass:426.1234015
Heavy Atom Count:30
Complexity:677

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC1=CC=C(C=C1)C(=O)CC2C=C(C(=CC2C(=O)C3=CC=CC=C3Cl)OC)OC

Technology Process of 2-[6-(2-Chlorobenzoyl)-3,4-dimethoxycyclohexa-2,4-dien-1-yl]-1-(4-methoxyphenyl)ethanone

There total 7 articles about 2-[6-(2-Chlorobenzoyl)-3,4-dimethoxycyclohexa-2,4-dien-1-yl]-1-(4-methoxyphenyl)ethanone 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: 76.0%

: 1333231-04-1
C₁₅H₂₁BO₄

: 5613-32-1
4-Iod-2,3-dimethyl-benzoesaeure-methylester

Guidance literature:: With chloroamine-T; sodium iodide; In tetrahydrofuran; water; at 0 - 23 ℃; for 13h; Inert atmosphere;
DOI:10.1002/anie.201102688

Reference yield:

: 5628-56-8
methyl 2,3-dimethyl-4-hydroxybenzene-1-carboxylate

: 5613-32-1
4-Iod-2,3-dimethyl-benzoesaeure-methylester

Guidance literature:: Multi-step reaction with 3 steps

1.1: sodium hydride / N,N-dimethyl-formamide; mineral oil / 0.5 h / 0 - 23 °C / Inert atmosphere

1.2: 12 h / 0 - 23 °C / Inert atmosphere

2.1: dichloro(1,1'-bis(diphenylphosphanyl)ferrocene)palladium(II)*CH₂Cl₂; potassium acetate / 1,4-dioxane / 18 h / 80 °C / Inert atmosphere

3.1: chloroamine-T; sodium iodide / tetrahydrofuran; water / 13 h / 0 - 23 °C / Inert atmosphere

With dichloro(1,1'-bis(diphenylphosphanyl)ferrocene)palladium(II)*CH₂Cl₂; potassium acetate; chloroamine-T; sodium hydride; sodium iodide; In tetrahydrofuran; 1,4-dioxane; water; N,N-dimethyl-formamide; mineral oil;
DOI:10.1002/anie.201102688

Reference yield:

: 1333231-03-0
C₁₁H₁₁F₃O₅S

: 5613-32-1
4-Iod-2,3-dimethyl-benzoesaeure-methylester

Guidance literature:: Multi-step reaction with 2 steps

1: dichloro(1,1'-bis(diphenylphosphanyl)ferrocene)palladium(II)*CH₂Cl₂; potassium acetate / 1,4-dioxane / 18 h / 80 °C / Inert atmosphere

2: chloroamine-T; sodium iodide / tetrahydrofuran; water / 13 h / 0 - 23 °C / Inert atmosphere

With dichloro(1,1'-bis(diphenylphosphanyl)ferrocene)palladium(II)*CH₂Cl₂; potassium acetate; chloroamine-T; sodium iodide; In tetrahydrofuran; 1,4-dioxane; water;
DOI:10.1002/anie.201102688