Phosphonic acid, [2-(4-fluorophenyl)-2-oxoethyl]-, dimethyl ester

Base Information

Chemical Name:Phosphonic acid, [2-(4-fluorophenyl)-2-oxoethyl]-, dimethyl ester
CAS No.:51638-12-1
Molecular Formula:C10H12FO4P
Molecular Weight:246.175
Hs Code.:
DSSTox Substance ID:DTXSID80456980
Wikidata:Q82279636
Mol file:51638-12-1.mol

Synonyms:51638-12-1;Phosphonic acid, [2-(4-fluorophenyl)-2-oxoethyl]-, dimethyl ester;SCHEMBL2322443;DTXSID80456980

Suppliers and Price of Phosphonic acid, [2-(4-fluorophenyl)-2-oxoethyl]-, dimethyl ester

Supply Marketing:

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

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Total 1 raw suppliers

Chemical Property of Phosphonic acid, [2-(4-fluorophenyl)-2-oxoethyl]-, dimethyl ester

Chemical Property:

XLogP3:2.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:246.04572402
Heavy Atom Count:16
Complexity:279

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COP(=O)(CC(=O)C1=CC=C(C=C1)F)OC

Technology Process of Phosphonic acid, [2-(4-fluorophenyl)-2-oxoethyl]-, dimethyl ester

There total 5 articles about Phosphonic acid, [2-(4-fluorophenyl)-2-oxoethyl]-, dimethyl ester 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: 90.0%

: 403-33-8
methyl 4-flurobenzoate

: 756-79-6
dimethyl methane phosphonate

: 51638-12-1
dimethyl [2-(p-fluorophenyl)-2-oxoethyl]phosphonate

Guidance literature:: With lithium diisopropyl amide; In tetrahydrofuran; hexane; at -20 - 20 ℃; Inert atmosphere;
DOI:10.1021/acs.orglett.0c01618

Reference yield: 55.0%

: 405-99-2
para-fluorostyrene

: 868-85-9
Dimethyl phosphite

: 51638-12-1
dimethyl [2-(p-fluorophenyl)-2-oxoethyl]phosphonate

Guidance literature:: With di-tert-butyl peroxide; copper(II) ferrite; triethylamine; In acetonitrile; at 85 ℃; for 6h;
DOI:10.1016/j.catcom.2020.106015

Reference yield:

: 456-22-4
4-Fluorobenzoic acid

: 51638-12-1
dimethyl [2-(p-fluorophenyl)-2-oxoethyl]phosphonate

Guidance literature:: Multi-step reaction with 2 steps

1: sulfuric acid / Reflux

2: n-butyllithium / tetrahydrofuran / -78 - 0 °C / Inert atmosphere

With n-butyllithium; sulfuric acid; In tetrahydrofuran;
DOI:10.1021/acs.jmedchem.0c01133