3-(4-Chlorophenyl)-1-(3,4-dimethoxyphenyl)prop-2-en-1-one

Base Information

Chemical Name:3-(4-Chlorophenyl)-1-(3,4-dimethoxyphenyl)prop-2-en-1-one
CAS No.:53744-30-2
Molecular Formula:C17H15ClO3
Molecular Weight:302.757
Hs Code.:
DSSTox Substance ID:DTXSID401177894
Nikkaji Number:J1.927.938C,J2.282.502J
ChEMBL ID:CHEMBL1935208
Mol file:53744-30-2.mol

Synonyms:53744-30-2;CHEMBL1935208;(2E)-3-(4-chlorophenyl)-1-(3,4-dimethoxyphenyl)prop-2-en-1-one;3-(4-chlorophenyl)-1-(3,4-dimethoxyphenyl)prop-2-en-1-one;177900-49-1;DTXSID401177894;4-Chloro-3',4'-dimethoxychalcone;BDBM50360500;MFCD00170624;STK520724;AKOS000991200;(E)-3',4'-Dimethoxy-4-chlorochalcone;1-(3,4-Dimethoxyphenyl)-3-(4-chlorophenyl)-2-propene-1-one;1-(3,4-Dimethoxyphenyl)-3-(4-chlorophenyl)prop-2-en-1-one;3-(4-Chlorophenyl)-1-(3,4-dimethoxyphenyl) prop-2-en-1-one;(2E)-3-(4-Chlorophenyl)-1-(3,4-dimethoxyphenyl)-2-propen-1-one

Suppliers and Price of 3-(4-Chlorophenyl)-1-(3,4-dimethoxyphenyl)prop-2-en-1-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
Packaging
price

Total 3 raw suppliers

Chemical Property of 3-(4-Chlorophenyl)-1-(3,4-dimethoxyphenyl)prop-2-en-1-one

Chemical Property:

XLogP3:4.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:302.0709720
Heavy Atom Count:21
Complexity:361

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:COC1=C(C=C(C=C1)C(=O)C=CC2=CC=C(C=C2)Cl)OC
Isomeric SMILES:COC1=C(C=C(C=C1)C(=O)/C=C/C2=CC=C(C=C2)Cl)OC

Technology Process of 3-(4-Chlorophenyl)-1-(3,4-dimethoxyphenyl)prop-2-en-1-one

There total 2 articles about 3-(4-Chlorophenyl)-1-(3,4-dimethoxyphenyl)prop-2-en-1-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: 98.0%

: 104-88-1
4-chlorobenzaldehyde

: 1131-62-0
1-(3,4-dimethoxyphenyl)ethanone

: 53744-30-2
BG₀₄₀₁

Guidance literature:: With sodium hydroxide; In methanol; at 20 ℃;
DOI:10.2174/1573406413666170525125730

Reference yield:

: 197227-41-1
(E)-1-(3,4-Dimethoxy-phenyl)-3-(2,3,4-trimethoxy-phenyl)-propenone

: 53744-30-2
BG₀₄₀₁

Guidance literature:: Multi-step reaction with 2 steps

1: TFA / 0.33 h / 120 °C / microwave irradiation

2: 76 percent / NaOH / methanol

With sodium hydroxide; trifluoroacetic acid; In methanol; 1: Nazarov cyclization / 2: Claisen-Schmidt condensation;
DOI:10.1016/j.tetlet.2005.12.110

Reference yield: 65.0%

: 53744-30-2
BG₀₄₀₁

: 586958-77-2
1-[1-(phenylsulfonyl)-1H-pyrrol-3-yl]-ethyl-2H-1,2,3-benzotriazole

: 5-(4-chlorophenyl)-7-(3,4-dimethoxyphenyl)-4-methyl-1-(phenylsulfonyl)-1H-indole

Guidance literature:: 1-[1-(phenylsulfonyl)-1H-pyrrol-3-yl]-ethyl-2H-1,2,3-benzotriazole; With n-butyllithium; In tetrahydrofuran; cyclohexane; at -78 ℃; for 0.166667h;

BG₀₄₀₁; In tetrahydrofuran; cyclohexane; at -78 - 20 ℃;

With sulfuric acid; In isopropyl alcohol; for 24h; Heating;
DOI:10.1021/jo026853m