1-(3-Phenyl-1,2,4-thiadiazol-5-yl)propan-2-one

Base Information

Chemical Name:1-(3-Phenyl-1,2,4-thiadiazol-5-yl)propan-2-one
CAS No.:78061-84-4
Molecular Formula:C11H10N2OS
Molecular Weight:218.279
Hs Code.:
DSSTox Substance ID:DTXSID40506899
Wikidata:Q82362866

Synonyms:1-(3-Phenyl-1,2,4-thiadiazol-5-yl)propan-2-one;78061-84-4;DTXSID40506899

Suppliers and Price of 1-(3-Phenyl-1,2,4-thiadiazol-5-yl)propan-2-one

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 1-(3-Phenyl-1,2,4-thiadiazol-5-yl)propan-2-one

Chemical Property:

XLogP3:2.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:218.05138412
Heavy Atom Count:15
Complexity:229

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=O)CC1=NC(=NS1)C2=CC=CC=C2

Technology Process of 1-(3-Phenyl-1,2,4-thiadiazol-5-yl)propan-2-one

There total 7 articles about 1-(3-Phenyl-1,2,4-thiadiazol-5-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: 60.0%

: 83609-56-7
3-Oxo-2-(3-phenyl-[1,2,4]thiadiazol-5-yl)-butyric acid tert-butyl ester

: 78061-84-4
5-(2-oxopropyl)-3-phenyl-1,2,4-thiadiazole

Guidance literature:: With toluene-4-sulfonic acid; In toluene; Heating;
DOI:10.1007/BF00809020

Reference yield: 48.0%

: (Z)-1-Methyl-2-(3-phenyl-[1,2,4]thiadiazol-5-yl)-vinylamine

: 78061-84-4
5-(2-oxopropyl)-3-phenyl-1,2,4-thiadiazole

Guidance literature:: With water; oxalic acid; In ethanol;

Reference yield:

: 24255-23-0
5-chloro-3-phenyl-[1,2,4]thiadiazole

: 78061-84-4
5-(2-oxopropyl)-3-phenyl-1,2,4-thiadiazole

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) 80percent NaH (paraffin emulsion) / 1.) THF, 2.) i-PrOH, 8 h, 60 deg C

2: 60 percent / p-CH₃C₆H₄SO₃H / toluene / Heating

With sodium hydride; toluene-4-sulfonic acid; In toluene;
DOI:10.1007/BF00809020