2-[4-(Trifluoromethylthio)phenyl]oxirane

Base Information

Chemical Name:2-[4-(Trifluoromethylthio)phenyl]oxirane
CAS No.:67764-94-7
Molecular Formula:C9H7F3OS
Molecular Weight:220.215
Hs Code.:
DSSTox Substance ID:DTXSID80474467
Nikkaji Number:J2.484.838H

Synonyms:67764-94-7;2-[4-(Trifluoromethylthio)phenyl]oxirane;AGN-PC-0OJKLB;SCHEMBL9576913;DTXSID80474467;APTAYJLKATVXKM-UHFFFAOYSA-N;EN300-1932257;(2R)-[4-[(trifluoromethyl)-thio]phenyl]-oxirane;J-500902;2-{4-[(TRIFLUOROMETHYL)SULFANYL]PHENYL}OXIRANE

Suppliers and Price of 2-[4-(Trifluoromethylthio)phenyl]oxirane

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

Total 1 raw suppliers

Chemical Property of 2-[4-(Trifluoromethylthio)phenyl]oxirane

Chemical Property:

XLogP3:3.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:220.01697050
Heavy Atom Count:14
Complexity:199

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1C(O1)C2=CC=C(C=C2)SC(F)(F)F

Technology Process of 2-[4-(Trifluoromethylthio)phenyl]oxirane

There total 1 articles about 2-[4-(Trifluoromethylthio)phenyl]oxirane 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: 75.0%

: 4021-50-5
4-(trifluoromethylthio)benzaldehyde

: 2181-42-2
trimethylsulphonium iodide

: 67764-94-7
(4-trifluoromethylthiophenyl)-oxirane

Guidance literature:: With sodium hydride; In dimethyl sulfoxide; at 20 ℃;
DOI:10.1002/adsc.200700085

Reference yield:

: 67764-94-7
(4-trifluoromethylthiophenyl)-oxirane

: 773837-37-9
sodium cyanide

: (S)-(4-trifluoromethylthiophenyl)-oxirane

: C₁₀H₈F₃NOS

: C₉H₇F₃OS

Guidance literature:: With halohydrin dehalogenase from Agrobacterium radiobacter AD₁, mutant W₂₄₉P; In aq. phosphate buffer; dimethyl sulfoxide; at 20 ℃; for 2h; pH=7; Resolution of racemate; Enzymatic reaction;
DOI:10.1016/j.catcom.2021.106285

Reference yield:

: 67764-94-7
(4-trifluoromethylthiophenyl)-oxirane

: (S)-(4-trifluoromethylthiophenyl)-oxirane

: (S)-1-(4-Trifluoromethylsulfanyl-phenyl)-ethane-1,2-diol

: (R)-1-(4-Trifluoromethylsulfanyl-phenyl)-ethane-1,2-diol

Guidance literature:: With Aspergillus niger epoxide hydrolase; In water; dimethyl sulfoxide; at 27 ℃; for 1h; Title compound not separated from byproducts;
DOI:10.1002/adsc.200606061