6-bromo-4-phenyl-3-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]-1H-quinolin-2-one

Base Information

Chemical Name:6-bromo-4-phenyl-3-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]-1H-quinolin-2-one
CAS No.:5219-15-8
Molecular Formula:C12H13 F O3
Molecular Weight:520.3713
Hs Code.:
DSSTox Substance ID:DTXSID90416737
Wikidata:Q82226243
Mol file:5219-15-8.mol

Synonyms:5219-15-8;AC1NSPWT;SCHEMBL243968;DTXSID90416737;SMSF0004686;AKOS000639252;CB07406;BIM-0005290.P001;Z207209930

Suppliers and Price of 6-bromo-4-phenyl-3-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]-1H-quinolin-2-one

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
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price

Total 1 raw suppliers

Chemical Property of 6-bromo-4-phenyl-3-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]-1H-quinolin-2-one

Chemical Property:

Vapor Pressure:4.02E-19mmHg at 25°C
Boiling Point:694.2°Cat760mmHg
Flash Point:373.7°C
Density:1.404g/cm³
XLogP3:5.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:519.06814
Heavy Atom Count:34
Complexity:791

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC1=CC(=CC(=C1OC)OC)C=CC(=O)C2=C(C3=C(C=CC(=C3)Br)NC2=O)C4=CC=CC=C4
Isomeric SMILES:COC1=CC(=CC(=C1OC)OC)/C=C/C(=O)C2=C(C3=C(C=CC(=C3)Br)NC2=O)C4=CC=CC=C4

Technology Process of 6-bromo-4-phenyl-3-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]-1H-quinolin-2-one

There total 4 articles about 6-bromo-4-phenyl-3-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]-1H-quinolin-2-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:

: 141-78-6
ethyl acetate

: 587-88-2
ethyl 2-(4-fluorophenyl)acetate

: 5219-15-8
ethyl 2-(4-fluorophenyl)-3-oxobutanoate

Guidance literature:: ethyl 2-(4-fluorophenyl)acetate; With sodium hydride; In tetrahydrofuran; mineral oil; at 0 - 20 ℃; for 2h;

ethyl acetate; In tetrahydrofuran; mineral oil; at 0 ℃; Reflux;

Reference yield:

: 141-97-9
ethyl acetoacetate

: 460-00-4
1-Bromo-4-fluorobenzene

: 5219-15-8
ethyl 2-(4-fluorophenyl)-3-oxobutanoate

Guidance literature:: With potassium phosphate; palladium diacetate; di-tert-butyl (2'-methyl-[1,1'-biphenyl]-2-yl)phosphine; In toluene; at 90 ℃; for 16h;
DOI:10.1016/j.bmcl.2011.11.069

Reference yield:

: 108-24-7
acetic anhydride

: 587-88-2
ethyl 2-(4-fluorophenyl)acetate

: 5219-15-8
ethyl 2-(4-fluorophenyl)-3-oxobutanoate

Guidance literature:: ethyl 2-(4-fluorophenyl)acetate; With sodium hydride; In tetrahydrofuran; at 60 ℃; for 0.5h; Inert atmosphere;

acetic anhydride; In tetrahydrofuran; at 0 ℃;
DOI:10.1002/anie.201700021