1-(5-Phenyl-1,2-oxazol-3-yl)propan-2-one

Base Information

Chemical Name:1-(5-Phenyl-1,2-oxazol-3-yl)propan-2-one
CAS No.:142231-26-3
Molecular Formula:C12H11NO2
Molecular Weight:201.225
Hs Code.:
DSSTox Substance ID:DTXSID50566409
Nikkaji Number:J481.853I
Wikidata:Q82452006

Synonyms:142231-26-3;1-(5-Phenyl-1,2-oxazol-3-yl)propan-2-one;DTXSID50566409

Suppliers and Price of 1-(5-Phenyl-1,2-oxazol-3-yl)propan-2-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

Total 1 raw suppliers

Chemical Property of 1-(5-Phenyl-1,2-oxazol-3-yl)propan-2-one

Chemical Property:

XLogP3:1.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:201.078978594
Heavy Atom Count:15
Complexity:224

Purity/Quality:: 99.90% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=O)CC1=NOC(=C1)C2=CC=CC=C2

Technology Process of 1-(5-Phenyl-1,2-oxazol-3-yl)propan-2-one

There total 5 articles about 1-(5-Phenyl-1,2-oxazol-3-yl)propan-2-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: 85.0%

: 467221-16-5
3-(2-methyl-[1,3]dioxolan-2-ylmethyl)-5-phenyl-isoxazole

: 142231-26-3
5-phenyl-3-(2-oxopropyl)isoxazole

Guidance literature:: With formic acid; In acetic acid; at 60 ℃; for 3h;
DOI:10.1016/S0040-4039(02)00567-1

Reference yield: 16.0%

: 1008-75-9
3-methyl-5-phenylisoxazole

: 141-78-6
ethyl acetate

: 127916-08-9
1-(3-methyl-5-phenylisoxazol-4-yl)ethanone

: 142231-26-3
5-phenyl-3-(2-oxopropyl)isoxazole

Guidance literature:: With n-butyllithium; 1.) -78 deg C, 5 h, 2.) 25 deg C, 1 h;

Reference yield:

: 591-50-4
iodobenzene

: 142231-26-3
5-phenyl-3-(2-oxopropyl)isoxazole

Guidance literature:: Multi-step reaction with 2 steps

1.1: PhNCO; Et₃N

1.2: AsPh₃ / Pd₂dba3 / dimethylformamide / 12 h / 60 °C

2.1: 85 percent / aq. formic acid / acetic acid / 3 h / 60 °C

With formic acid; phenyl isocyanate; triethylamine; In acetic acid; 1.2: Stille coupling;
DOI:10.1016/S0040-4039(02)00567-1