Methyl 4-(5-(4-fluorophenyl)-3-isoxazolyl)benzeneacetate

Base Information

Chemical Name:Methyl 4-(5-(4-fluorophenyl)-3-isoxazolyl)benzeneacetate
CAS No.:78868-49-2
Molecular Formula:C₁₈H₁₄FNO₃
Molecular Weight:311.312
Hs Code.:
DSSTox Substance ID:DTXSID301000101
Wikidata:Q82993489

Synonyms:BRN 4521074;78868-49-2;Methyl 4-(5-(4-fluorophenyl)-3-isoxazolyl)benzeneacetate;Benzeneacetic acid, 4-(5-(4-fluorophenyl)-3-isoxazolyl)-, methyl ester;DTXSID301000101;LS-28811;Methyl {4-[5-(4-fluorophenyl)-1,2-oxazol-3-yl]phenyl}acetate

Suppliers and Price of Methyl 4-(5-(4-fluorophenyl)-3-isoxazolyl)benzeneacetate

Supply Marketing:

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

Manufacturers and distributors:

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Chemical Property of Methyl 4-(5-(4-fluorophenyl)-3-isoxazolyl)benzeneacetate

Chemical Property:

Vapor Pressure:1.25E-08mmHg at 25°C
Boiling Point:459.6°Cat760mmHg
Flash Point:231.7°C
Density:1.23g/cm³
XLogP3:3.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:311.09577147
Heavy Atom Count:23
Complexity:390

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC(=O)CC1=CC=C(C=C1)C2=NOC(=C2)C3=CC=C(C=C3)F

Technology Process of Methyl 4-(5-(4-fluorophenyl)-3-isoxazolyl)benzeneacetate

There total 5 articles about Methyl 4-(5-(4-fluorophenyl)-3-isoxazolyl)benzeneacetate 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: 56.0%

: 67-56-1
methanol

: 78868-41-4
{4-[5-(4-Fluoro-phenyl)-isoxazol-3-yl]-phenyl}-acetic acid

: 78868-49-2
{4-[5-(4-Fluoro-phenyl)-isoxazol-3-yl]-phenyl}-acetic acid methyl ester

Guidance literature:: With sulfuric acid;

Reference yield:

: 7398-52-9
4-acetyl-phenylacetic acid

: 78868-49-2
{4-[5-(4-Fluoro-phenyl)-isoxazol-3-yl]-phenyl}-acetic acid methyl ester

Guidance literature:: Multi-step reaction with 4 steps

1: 60 percent / 40percent aq. NaOH / ethanol

2: 57 percent / bromine / diethyl ether

3: 42 percent / NH₂OH*HCl, 40percent aq. NaOH / methanol

4: 56 percent / conc. H₂SO₄

With sodium hydroxide; sulfuric acid; hydroxylamine hydrochloride; bromine; In methanol; diethyl ether; ethanol;

Reference yield:

: 459-57-4
4-fluorobenzaldehyde

: 78868-49-2
{4-[5-(4-Fluoro-phenyl)-isoxazol-3-yl]-phenyl}-acetic acid methyl ester

Guidance literature:: Multi-step reaction with 4 steps

1: 60 percent / 40percent aq. NaOH / ethanol

2: 57 percent / bromine / diethyl ether

3: 42 percent / NH₂OH*HCl, 40percent aq. NaOH / methanol

4: 56 percent / conc. H₂SO₄

With sodium hydroxide; sulfuric acid; hydroxylamine hydrochloride; bromine; In methanol; diethyl ether; ethanol;