3-(Chloromethyl)-5-(2-fluorophenyl)-1,2,4-oxadiazole

Base Information

Chemical Name:3-(Chloromethyl)-5-(2-fluorophenyl)-1,2,4-oxadiazole
CAS No.:844499-00-9
Molecular Formula:C₉H₆ClFN₂O
Molecular Weight:212.611
Hs Code.:2934999090
DSSTox Substance ID:DTXSID50587472
Wikidata:Q72454024
Mol file:844499-00-9.mol

Synonyms:3-(chloromethyl)-5-(2-fluorophenyl)-1,2,4-oxadiazole;844499-00-9;SCHEMBL12072153;DTXSID50587472;MFCD09027636;STL097611;AKOS005725019;MCULE-8677043557;EN300-7456909;A840785

Suppliers and Price of 3-(Chloromethyl)-5-(2-fluorophenyl)-1,2,4-oxadiazole

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

Crysdot
3-(Chloromethyl)-5-(2-fluorophenyl)-1,2,4-oxadiazole 95+%
1g
$ 762.00

American Custom Chemicals Corporation
3-(CHLOROMETHYL)-5-(2-FLUOROPHENYL)-1,2,4-OXADIAZOLE 95.00%
5MG
$ 505.23

AK Scientific
3-(Chloromethyl)-5-(2-fluorophenyl)-1,2,4-oxadiazole
10g
$ 2002.00

AK Scientific
3-(Chloromethyl)-5-(2-fluorophenyl)-1,2,4-oxadiazole
2.5g
$ 966.00

AK Scientific
3-(Chloromethyl)-5-(2-fluorophenyl)-1,2,4-oxadiazole
1g
$ 542.00

AK Scientific
3-(Chloromethyl)-5-(2-fluorophenyl)-1,2,4-oxadiazole
100mg
$ 214.00

Total 14 raw suppliers

Chemical Property of 3-(Chloromethyl)-5-(2-fluorophenyl)-1,2,4-oxadiazole

Chemical Property:

Vapor Pressure:0.000652mmHg at 25°C
Refractive Index:1.542
Boiling Point:319 °C at 760 mmHg
Flash Point:146.7 °C
PSA：38.92000
Density:1.364 g/cm³
LogP:2.61450
Storage Temp.:2-8°C
XLogP3:2.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:212.0152687
Heavy Atom Count:14
Complexity:196

Purity/Quality:

97% ^*data from raw suppliers

3-(Chloromethyl)-5-(2-fluorophenyl)-1,2,4-oxadiazole 95+% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C(=C1)C2=NC(=NO2)CCl)F

Technology Process of 3-(Chloromethyl)-5-(2-fluorophenyl)-1,2,4-oxadiazole

There total 4 articles about 3-(Chloromethyl)-5-(2-fluorophenyl)-1,2,4-oxadiazole 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: 7.4%

: 844499-00-9
3-chloromethyl-5-(2-fluoro-phenyl)-[1,2,4]oxadiazole

Guidance literature:

Reference yield:

: 393-52-2
2-Fluorobenzoyl chloride

: 844499-00-9
3-chloromethyl-5-(2-fluoro-phenyl)-[1,2,4]oxadiazole

Guidance literature:: Multi-step reaction with 2 steps

1: DIEA / CH₂Cl₂ / 24 h / 20 °C

2: toluene / 24 h / Heating

With N-ethyl-N,N-diisopropylamine; In dichloromethane; toluene;
DOI:10.1016/j.bmcl.2004.11.044