Benzeneacetic acid, 4-(5-(4-methoxyphenyl)-3-isoxazolyl)-, methyl ester

Base Information

Chemical Name:Benzeneacetic acid, 4-(5-(4-methoxyphenyl)-3-isoxazolyl)-, methyl ester
CAS No.:78868-50-5
Molecular Formula:C₁₉H₁₇NO₄
Molecular Weight:323.348
Hs Code.:
DSSTox Substance ID:DTXSID40229354

Synonyms:BRN 4530206;Benzeneacetic acid, 4-(5-(4-methoxyphenyl)-3-isoxazolyl)-, methyl ester;78868-50-5;Methyl 4-(5-(4-methoxyphenyl)-3-isoxazolyl)benzeneacetate;DTXSID40229354;LS-28897

Suppliers and Price of Benzeneacetic acid, 4-(5-(4-methoxyphenyl)-3-isoxazolyl)-, methyl ester

Supply Marketing:

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

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Chemical Property of Benzeneacetic acid, 4-(5-(4-methoxyphenyl)-3-isoxazolyl)-, methyl ester

Chemical Property:

Vapor Pressure:8.23E-10mmHg at 25°C
Boiling Point:491.6°C at 760 mmHg
Flash Point:251.1°C
Density:1.185g/cm³
XLogP3:3.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:323.11575802
Heavy Atom Count:24
Complexity:400

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC1=CC=C(C=C1)C2=CC(=NO2)C3=CC=C(C=C3)CC(=O)OC

Technology Process of Benzeneacetic acid, 4-(5-(4-methoxyphenyl)-3-isoxazolyl)-, methyl ester

There total 4 articles about Benzeneacetic acid, 4-(5-(4-methoxyphenyl)-3-isoxazolyl)-, methyl 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: 80.0%

: 67-56-1
methanol

: 78868-42-5
{4-[5-(4-Methoxy-phenyl)-isoxazol-3-yl]-phenyl}-acetic acid

: 78868-50-5
{4-[5-(4-Methoxy-phenyl)-isoxazol-3-yl]-phenyl}-acetic acid methyl ester

Guidance literature:: With sulfuric acid;

Reference yield:

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

: 78868-50-5
{4-[5-(4-Methoxy-phenyl)-isoxazol-3-yl]-phenyl}-acetic acid methyl ester

Guidance literature:: Multi-step reaction with 4 steps

1: 67 percent / 40percent aq. NaOH / ethanol

2: 60 percent / bromine / diethyl ether

3: 50 percent / NH₂OH*HCl, 40percent aq. NaOH / methanol

4: 80 percent / conc. H₂SO₄

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

Reference yield:

: 78868-27-6
{4-[(E)-3-(4-Methoxy-phenyl)-acryloyl]-phenyl}-acetic acid

: 78868-50-5
{4-[5-(4-Methoxy-phenyl)-isoxazol-3-yl]-phenyl}-acetic acid methyl ester

Guidance literature:: Multi-step reaction with 3 steps

1: 60 percent / bromine / diethyl ether

2: 50 percent / NH₂OH*HCl, 40percent aq. NaOH / methanol

3: 80 percent / conc. H₂SO₄

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