5-(4-Fluorophenyl)-1,3,4-oxadiazol-2(3H)-one

Base Information

Chemical Name:5-(4-Fluorophenyl)-1,3,4-oxadiazol-2(3H)-one
CAS No.:121649-18-1
Molecular Formula:C8H5 F N2 O2
Molecular Weight:180.138
Hs Code.:2934999090
European Community (EC) Number:808-442-3
DSSTox Substance ID:DTXSID10368906
Nikkaji Number:J3.201.854H
Wikidata:Q82155793
Pharos Ligand ID:GH5NGW49RBVP
ChEMBL ID:CHEMBL4761164
Mol file:121649-18-1.mol

Synonyms:121649-18-1;5-(4-FLUOROPHENYL)-1,3,4-OXADIAZOL-2(3H)-ONE;5-(4-fluorophenyl)-3H-1,3,4-oxadiazol-2-one;5-(4-fluorophenyl)-2,3-dihydro-1,3,4-oxadiazol-2-one;CHEMBL4761164;5-(4-fluorophenyl)-1,3,4-oxadiazol-2-ol;SCHEMBL5544153;SCHEMBL23451582;DTXSID10368906;BDBM600859;HMS1783H04;US11634391, Compound 84;BDBM50554474;ODC101309;AKOS008968671;BS-21035;CS-0213233;FT-0660707;EN300-18469;A927300;5-(4-Fluorophenyl)-1,3,4-oxadiazole-2(3H)-one;Z57980676;3-amino-1,1,1-trifluoro-2-(3-fluorophenyl)propan-2-ol;5-(4-Fluorophenyl)-1,3,4-oxadiazol-2(3H)-one, AldrichCPR

Suppliers and Price of 5-(4-Fluorophenyl)-1,3,4-oxadiazol-2(3H)-one

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)-3H-1,3,4-oxadiazol-2-one
250mg
$ 75.00

Sigma-Aldrich
5-(4-Fluorophenyl)-1,3,4-oxadiazol-2(3H)-one Aldrich
1g
$ 277.00

Heterocyclics
5-(4-Fluorophenyl)-1,3,4-oxadiazol-2(3H)-one 98%
1g
$ 200.00

Heterocyclics
5-(4-Fluorophenyl)-1,3,4-oxadiazol-2(3H)-one 98%
5g
$ 600.00

Crysdot
5-(4-Fluorophenyl)-1,3,4-oxadiazol-2(3H)-one 95+%
5g
$ 640.00

AK Scientific
5-(4-Fluorophenyl)-1,3,4-oxadiazol-2(3H)-one
5g
$ 810.00

AK Scientific
5-(4-Fluorophenyl)-1,3,4-oxadiazol-2(3H)-one
250mg
$ 332.00

Total 10 raw suppliers

Chemical Property of 5-(4-Fluorophenyl)-1,3,4-oxadiazol-2(3H)-one

Chemical Property:

PSA：58.89000
LogP:1.16900
XLogP3:1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:180.03350557
Heavy Atom Count:13
Complexity:247

Purity/Quality:

97% ^*data from raw suppliers

5-(4-Fluorophenyl)-3H-1,3,4-oxadiazol-2-one ^*data from reagent suppliers

Safty Information:

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

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC=C1C2=NNC(=O)O2)F

Technology Process of 5-(4-Fluorophenyl)-1,3,4-oxadiazol-2(3H)-one

There total 10 articles about 5-(4-Fluorophenyl)-1,3,4-oxadiazol-2(3H)-one 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: 90.0%

: 124-38-9,18923-20-1
carbon dioxide

: 456-06-4
4-fluorobenzoyl hydrazide

: 121649-18-1
5-(4-fluorophenyl)-3H-[1,3,4]oxadiazol-2-one

Guidance literature:: With potassium hydroxide; In ethanol; at 50 ℃; for 4h; Green chemistry;
DOI:10.1039/c5ra08910g

Reference yield: 88.0%

: 1422157-59-2
N′-[chloro-(4-fluorophenyl)methylene]-tert-butylcarbazate

: 121649-18-1
5-(4-fluorophenyl)-3H-[1,3,4]oxadiazol-2-one

Guidance literature:: With basic alumina; In chloroform; at 85 ℃; for 0.25h; Green chemistry;
DOI:10.1016/j.tetlet.2012.11.128

Reference yield: 82.0%

: 201230-82-2
carbon monoxide

: 456-06-4
4-fluorobenzoyl hydrazide

: 121649-18-1
5-(4-fluorophenyl)-3H-[1,3,4]oxadiazol-2-one

Guidance literature:: With palladium(II) trifluoroacetate; acetonitrile; trifluoroacetic acid; copper(II) oxide; at 60 ℃; for 12h;
DOI:10.1021/acs.joc.5b00664