(4S,5R)-4-(Fluoromethyl)-4,5-dihydro-5-[4-(methylsulfonyl)phenyl]-2-phenyloxazole

Base Information Edit

Chemical Name:(4S,5R)-4-(Fluoromethyl)-4,5-dihydro-5-[4-(methylsulfonyl)phenyl]-2-phenyloxazole
CAS No.:126428-97-5
Molecular Formula:C17H16FNO3S
Molecular Weight:333.383
Hs Code.:
European Community (EC) Number:603-138-5
DSSTox Substance ID:DTXSID80454825
Nikkaji Number:J1.384.627H
Wikidata:Q82276589
Mol file:126428-97-5.mol

Synonyms:126428-97-5;(4S,5R)-4-(Fluoromethyl)-4,5-dihydro-5-[4-(methylsulfonyl)phenyl]-2-phenyloxazole;(4S,5R)-4-(fluoromethyl)-5-(4-methylsulfonylphenyl)-2-phenyl-4,5-dihydro-1,3-oxazole;SCHEMBL1834801;DTXSID80454825;AMZCJDBNQOWJJF-HZPDHXFCSA-N;(4S,5R)-4,5-Dihydro-2-phenyl-4-(fluoromethyl)-5-[4-(methylsulfonyl)phenyl]oxazole

Suppliers and Price of (4S,5R)-4-(Fluoromethyl)-4,5-dihydro-5-[4-(methylsulfonyl)phenyl]-2-phenyloxazole

Supply Marketing:Edit

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
(4S,5R)-4-(Fluoromethyl)-4,5-dihydro-5-[4-(methylsulfonyl)phenyl]-2-phenyloxazole
25mg
$ 165.00

Total 2 raw suppliers

Chemical Property of (4S,5R)-4-(Fluoromethyl)-4,5-dihydro-5-[4-(methylsulfonyl)phenyl]-2-phenyloxazole Edit

Chemical Property:

Vapor Pressure:0mmHg at 25°C
Melting Point:117-119 °C
Boiling Point:533.293oC at 760 mmHg
PKA:2.58±0.70(Predicted)
Flash Point:276.326oC
PSA：64.11000
Density:1.31±0.1 g/cm3(Predicted)
LogP:3.46270
XLogP3:2.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:333.08349271
Heavy Atom Count:23
Complexity:529

Purity/Quality:

97% ^*data from raw suppliers

(4S,5R)-4-(Fluoromethyl)-4,5-dihydro-5-[4-(methylsulfonyl)phenyl]-2-phenyloxazole ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CS(=O)(=O)C1=CC=C(C=C1)C2C(N=C(O2)C3=CC=CC=C3)CF
Isomeric SMILES:CS(=O)(=O)C1=CC=C(C=C1)[C@@H]2[C@H](N=C(O2)C3=CC=CC=C3)CF
Uses (4S,5R)-4-(FluoroMethyl)-4,5-dihydro-5-[4-(Methylsulfonyl)phenyl]-2-phenyloxazole is an intermediate used in the synthesis of Florfenicol (F405750) and its analogues.

Technology Process of (4S,5R)-4-(Fluoromethyl)-4,5-dihydro-5-[4-(methylsulfonyl)phenyl]-2-phenyloxazole

There total 17 articles about (4S,5R)-4-(Fluoromethyl)-4,5-dihydro-5-[4-(methylsulfonyl)phenyl]-2-phenyloxazole 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:

: 96795-00-5
D-threo-4,5-dihydro-5-(4-methylsulphonylphenyl)-2-phenyl-4-oxazolemethanol

: 126428-97-5
D-(-)-threo-2-phenyl-4-(fluoromethyl)-5-(4-(methylsulfonyl)phenyl)-2-oxazoline

Guidance literature:: With hexafluoropropene-diethylamine adduct; In dichloromethane; at 100 ℃; for 2h; under 5171.5 Torr;
DOI:10.1021/jo00305a027