5-(4-Fluorophenyl)isoxazole

Base Information

Chemical Name:5-(4-Fluorophenyl)isoxazole
CAS No.:138716-37-7
Molecular Formula:C9H6FNO
Molecular Weight:163.151
Hs Code.:2934999090
European Community (EC) Number:642-611-0
DSSTox Substance ID:DTXSID20379184
Nikkaji Number:J2.606.451A
Wikidata:Q82168881
Mol file:138716-37-7.mol

Synonyms:5-(4-Fluorophenyl)isoxazole;138716-37-7;5-(4-fluorophenyl)-1,2-oxazole;SCHEMBL9679859;DTXSID20379184;MFCD02183544;AKOS005257874;FS-2076;5-(4-Fluorophenyl)isoxazole, AldrichCPR;CS-0206141;D95859

Suppliers and Price of 5-(4-Fluorophenyl)isoxazole

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

TRC
5-(4-Fluorophenyl)isoxazole
250mg
$ 55.00

TRC
5-(4-Fluorophenyl)isoxazole
500mg
$ 65.00

SynQuest Laboratories
5-(4-Fluorophenyl)isoxazole
25 g
$ 155.00

Sigma-Aldrich
5-(4-Fluorophenyl)isoxazole Aldrich
1g
$ 57.00

Oakwood
5-(4-Fluorophenyl)isoxazole 95%
1g
$ 10.00

Matrix Scientific
5-(4-Fluorophenyl)isoxazole
1g
$ 10.00

Crysdot
5-(4-Fluorophenyl)isoxazole 98%
500g
$ 723.00

Chemenu
5-(4-Fluorophenyl)isoxazole 98%
500g
$ 683.00

Apolloscientific
5-(4-Fluorophenyl)isoxazole
5g
$ 95.00

Apolloscientific
5-(4-Fluorophenyl)isoxazole
1g
$ 45.00

Total 16 raw suppliers

Chemical Property of 5-(4-Fluorophenyl)isoxazole

Chemical Property:

Vapor Pressure:0.00838mmHg at 25°C
Melting Point:53-56 °C
Refractive Index:1.523
Boiling Point:275.8 °C at 760 mmHg
PKA:-3.09±0.10(Predicted)
Flash Point:120.6 °C
PSA：26.03000
Density:1.209 g/cm³
LogP:2.48070
XLogP3:2.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:163.043341977
Heavy Atom Count:12
Complexity:146

Purity/Quality:

98%min ^*data from raw suppliers

5-(4-Fluorophenyl)isoxazole ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xi
Hazard Codes:Xi,Xn
Statements: 22

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC=C1C2=CC=NO2)F

Technology Process of 5-(4-Fluorophenyl)isoxazole

There total 8 articles about 5-(4-Fluorophenyl)isoxazole 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: 97.0%

: 138716-20-8
(E)-3-(dimethylamino)-1-(4-fluorophenyl)prop-2-en-1-one

: 138716-37-7
5-(4-fluorophenyl)isoxazole

Guidance literature:: With hydroxylamine hydrochloride; In methanol; at 65 ℃; for 2.5h;
DOI:10.1016/j.bmc.2007.10.079

Reference yield: 86.0%

: C₁₆H₁₄FN

: 138716-37-7
5-(4-fluorophenyl)isoxazole

Guidance literature:: With N-hydroxyphthalimide; [bis(acetoxy)iodo]benzene; In ethyl acetate; at 20 ℃; for 12h;
DOI:10.1016/j.tetlet.2018.04.062

Reference yield: 81.0%

: 54012-23-6
1-(4-fluorophenyl)prop-2-yn-1-one

: 138716-37-7
5-(4-fluorophenyl)isoxazole

Guidance literature:: 1-(4-fluorophenyl)prop-2-yn-1-one; With 2,2,6,6-Tetramethyl-1-piperidinyloxy free radical; trimethylsilylazide; In methanol; at 25 ℃; for 12h;

With triphenylphosphine; In methanol; for 1h;
DOI:10.1039/c6ra11099a