4-(5-(4-Fluorophenyl)-3-isoxazolyl)-alpha-methylbenzeneacetic acid

Base Information

Chemical Name:4-(5-(4-Fluorophenyl)-3-isoxazolyl)-alpha-methylbenzeneacetic acid
CAS No.:78868-45-8
Molecular Formula:C₁₈H₁₄FNO₃
Molecular Weight:311.312
Hs Code.:
DSSTox Substance ID:DTXSID101000098

Synonyms:BRN 4524288;4-(5-(4-Fluorophenyl)-3-isoxazolyl)-alpha-methylbenzeneacetic acid;Benzeneacetic acid, 4-(5-(4-fluorophenyl)-3-isoxazolyl)-alpha-methyl-;78868-45-8;DTXSID101000098;LS-28810;2-{4-[5-(4-Fluorophenyl)-1,2-oxazol-3-yl]phenyl}propanoic acid

Suppliers and Price of 4-(5-(4-Fluorophenyl)-3-isoxazolyl)-alpha-methylbenzeneacetic acid

Supply Marketing:

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

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Chemical Property of 4-(5-(4-Fluorophenyl)-3-isoxazolyl)-alpha-methylbenzeneacetic acid

Chemical Property:

Vapor Pressure:5.42E-11mmHg at 25°C
Boiling Point:504.3°Cat760mmHg
Flash Point:258.8°C
Density:1.271g/cm³
XLogP3:3.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:311.09577147
Heavy Atom Count:23
Complexity:403

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

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

Technology Process of 4-(5-(4-Fluorophenyl)-3-isoxazolyl)-alpha-methylbenzeneacetic acid

There total 4 articles about 4-(5-(4-Fluorophenyl)-3-isoxazolyl)-alpha-methylbenzeneacetic acid 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: 45.0%

: 78868-37-8
2-{4-[2,3-Dibromo-3-(4-fluoro-phenyl)-propionyl]-phenyl}-propionic acid

: 78868-45-8
2-{4-[5-(4-Fluoro-phenyl)-isoxazol-3-yl]-phenyl}-propionic acid

Guidance literature:: With sodium hydroxide; hydroxylamine hydrochloride; In methanol;

Reference yield:

: 41387-29-5
2-[4-(acetyl)phenyl] propanoic acid

: 78868-45-8
2-{4-[5-(4-Fluoro-phenyl)-isoxazol-3-yl]-phenyl}-propionic acid

Guidance literature:: Multi-step reaction with 3 steps

1: 50 percent / 40percent aq. NaOH / ethanol

2: 72 percent / bromine / diethyl ether

3: 45 percent / NH₂OH*HCl, 40percent aq. NaOH / methanol

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

Reference yield:

: 459-57-4
4-fluorobenzaldehyde

: 78868-45-8
2-{4-[5-(4-Fluoro-phenyl)-isoxazol-3-yl]-phenyl}-propionic acid

Guidance literature:: Multi-step reaction with 3 steps

1: 50 percent / 40percent aq. NaOH / ethanol

2: 72 percent / bromine / diethyl ether

3: 45 percent / NH₂OH*HCl, 40percent aq. NaOH / methanol

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