3-(4-Chlorophenyl)-1,2-oxazole-5-carboxylic acid

Base Information

Chemical Name:3-(4-Chlorophenyl)-1,2-oxazole-5-carboxylic acid
CAS No.:338982-11-9
Molecular Formula:C10H6ClNO3
Molecular Weight:223.616
Hs Code.:2934999090
European Community (EC) Number:870-726-8
DSSTox Substance ID:DTXSID10376925
Wikidata:Q82165863
ChEMBL ID:CHEMBL4584722
Mol file:338982-11-9.mol

Synonyms:338982-11-9;3-(4-chlorophenyl)-1,2-oxazole-5-carboxylic acid;3-(4-chlorophenyl)isoxazole-5-carboxylic acid;5-Isoxazolecarboxylic acid, 3-(4-chlorophenyl)-;3-(4-chlorophenyl)-5-isoxazolecarboxylic acid;3-(4-Chloro-phenyl)-isoxazole-5-carboxylic acid;SCHEMBL3611504;CHEMBL4584722;DTXSID10376925;COIATTMFFQMKKS-UHFFFAOYSA-N;AMY42333;MFCD01935955;AKOS000303161;11L-366S;CS-0051744;3-(4-chlorophenyl)isoxazole-5-carboxylicacid;EN300-380448;P17122;3-(4-chlorophenyl)-isoxazole-5-carboxylic acid;Z369737798

Suppliers and Price of 3-(4-Chlorophenyl)-1,2-oxazole-5-carboxylic acid

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

Matrix Scientific
3-(4-Chlorophenyl)-5-isoxazolecarboxylic acid
1g
$ 400.00

Crysdot
3-(4-Chlorophenyl)isoxazole-5-carboxylicacid 95+%
1g
$ 374.00

American Custom Chemicals Corporation
3-(4-CHLOROPHENYL)-5-ISOXAZOLECARBOXYLIC ACID 95.00%
5G
$ 1958.30

American Custom Chemicals Corporation
3-(4-CHLOROPHENYL)-5-ISOXAZOLECARBOXYLIC ACID 95.00%
1G
$ 1060.52

American Custom Chemicals Corporation
3-(4-CHLOROPHENYL)-5-ISOXAZOLECARBOXYLIC ACID 95.00%
10G
$ 2847.88

AK Scientific
3-(4-Chlorophenyl)-5-isoxazolecarboxylicacid
5g
$ 2444.00

AK Scientific
3-(4-Chlorophenyl)-5-isoxazolecarboxylicacid
100mg
$ 210.80

Total 8 raw suppliers

Chemical Property of 3-(4-Chlorophenyl)-1,2-oxazole-5-carboxylic acid

Chemical Property:

Melting Point:185-186 °C
Boiling Point:457.3±35.0 °C(Predicted)
PKA:2.14±0.10(Predicted)
PSA：63.33000
Density:1.440±0.06 g/cm3(Predicted)
LogP:2.69320
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:223.0036207
Heavy Atom Count:15
Complexity:241

Purity/Quality:

99%, ^*data from raw suppliers

3-(4-Chlorophenyl)-5-isoxazolecarboxylic acid ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC=C1C2=NOC(=C2)C(=O)O)Cl

Technology Process of 3-(4-Chlorophenyl)-1,2-oxazole-5-carboxylic acid

There total 9 articles about 3-(4-Chlorophenyl)-1,2-oxazole-5-carboxylic 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: 98.0%

: 471-25-0
Propiolic acid

: 28123-63-9
4-chlorobenzohydroximoyl chloride

: 338982-11-9
3-(4-chlorophenyl)-5-isoxazolylcarboxylic acid

Guidance literature:: With copper; triethylamine; In acetonitrile; at 20 ℃; for 0.416667h; Solvent; Concentration; Time; regioselective reaction; Inert atmosphere;
DOI:10.1002/jhet.2065