4-[5-Methoxy-2-(phenylethynyl)phenyl]butan-2-one

Base Information

Chemical Name:4-[5-Methoxy-2-(phenylethynyl)phenyl]butan-2-one
CAS No.:112399-16-3
Molecular Formula:C19H18O2
Molecular Weight:278.351
Hs Code.:
DSSTox Substance ID:DTXSID70554520
Wikidata:Q82435550

Synonyms:112399-16-3;4-[5-Methoxy-2-(phenylethynyl)phenyl]butan-2-one;SCHEMBL9217342;DTXSID70554520;URVMOAXBWMHYCI-UHFFFAOYSA-N;4-[5-Methoxy-2-(phenylethynyl)phenyl]-2-butanone

Suppliers and Price of 4-[5-Methoxy-2-(phenylethynyl)phenyl]butan-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
Packaging
price

Total 1 raw suppliers

Chemical Property of 4-[5-Methoxy-2-(phenylethynyl)phenyl]butan-2-one

Chemical Property:

XLogP3:3.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:6
Exact Mass:278.130679813
Heavy Atom Count:21
Complexity:394

Purity/Quality:: 99.90% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=O)CCC1=C(C=CC(=C1)OC)C#CC2=CC=CC=C2

Technology Process of 4-[5-Methoxy-2-(phenylethynyl)phenyl]butan-2-one

There total 2 articles about 4-[5-Methoxy-2-(phenylethynyl)phenyl]butan-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: 87.0%

: 536-74-3
phenylacetylene

: 99254-53-2
4-(2-iodo-5-methoxyphenyl)-2-butanone

: 112399-16-3
4-<5-methoxy-2-(phenylethynyl)phenyl>-2-butanone

Guidance literature:: With copper(l) iodide; tetrakis(triphenylphosphine) palladium⁽⁰⁾; triethylamine; In tetrahydrofuran; at 25 ℃; for 66h;
DOI:10.1021/jm00398a023

Reference yield:

: 4-Hydroxy-4-(phenylethynyl)-5-[2-(2,5,5-trimethyl-1,3-dioxan-2-yl)ethyl]-2-cyclohexen-1-one

: 112399-16-3
4-<5-methoxy-2-(phenylethynyl)phenyl>-2-butanone

Guidance literature:: In methanol; water;

Reference yield:

: 120-20-7
2-(3,4-dimethoxyphenyl)-ethylamine

: 112399-16-3
4-<5-methoxy-2-(phenylethynyl)phenyl>-2-butanone

: 112595-83-2
N-<2-(3,4-dimethoxyphenyl)ethyl>-5-methoxy-α-methyl-2-(phenethyl)benzenepropanamine

Guidance literature:: With sodium tetrahydroborate; toluene-4-sulfonic acid; Multistep reaction; 1.) toluene, reflux, 20 h, 2.) MeOH, 2 h;
DOI:10.1021/jm00398a023