2-(2-m-Tolylpropan-2-yl)-1,3,4-oxadiazole

Base Information

Chemical Name:2-(2-m-Tolylpropan-2-yl)-1,3,4-oxadiazole
CAS No.:1026444-42-7
Molecular Formula:C12H14N2O
Molecular Weight:202.25236
Hs Code.:
DSSTox Substance ID:DTXSID80440723
Wikidata:Q72492947
Mol file:1026444-42-7.mol

Synonyms:2-(2-m-tolylpropan-2-yl)-1,3,4-oxadiazole;1026444-42-7;2-[2-(3-methylphenyl)propan-2-yl]-1,3,4-oxadiazole;2-(2-(m-Tolyl)propan-2-yl)-1,3,4-oxadiazole;DTXSID80440723;AKOS005145980;FT-0730336

Suppliers and Price of 2-(2-m-Tolylpropan-2-yl)-1,3,4-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

American Custom Chemicals Corporation
2-(2-M-TOLYLPROPAN-2-YL)-1,3,4-OXADIAZOLE 95.00%
5MG
$ 496.96

Total 7 raw suppliers

Chemical Property of 2-(2-m-Tolylpropan-2-yl)-1,3,4-oxadiazole

Chemical Property:

PSA：38.92000
Density:1.074
LogP:2.70390
XLogP3:2.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:202.110613074
Heavy Atom Count:15
Complexity:218

Purity/Quality:

97% ^*data from raw suppliers

2-(2-M-TOLYLPROPAN-2-YL)-1,3,4-OXADIAZOLE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC(=CC=C1)C(C)(C)C2=NN=CO2

Technology Process of 2-(2-m-Tolylpropan-2-yl)-1,3,4-oxadiazole

There total 2 articles about 2-(2-m-Tolylpropan-2-yl)-1,3,4-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:

: 32454-26-5
methyl α-(3-methylphenyl)isobutyrate

: 1026444-42-7
2-(1-methyl-1-m-tolyl-ethyl)-[1,3,4]oxadiazole

Guidance literature:: Multi-step reaction with 2 steps

1: hydrazine hydrate / 6.5 h / Heating

2: 10 h / Heating

With hydrazine hydrate;
DOI:10.1021/jm000410y

Reference yield:

: 122-51-0
orthoformic acid triethyl ester

: 1027543-64-1
2-methyl-2-m-tolyl-propionic acid hydrazide

: 1026444-42-7
2-(1-methyl-1-m-tolyl-ethyl)-[1,3,4]oxadiazole

Guidance literature:: for 10h; Heating;
DOI:10.1021/jm000410y

Reference yield:

: 79069-51-5
(S)-N-tert-butoxycarbonylvalinal

: 1026444-42-7
2-(1-methyl-1-m-tolyl-ethyl)-[1,3,4]oxadiazole

: 1027494-17-2
(1-{hydroxy-[5-(1-methyl-1-m-tolyl-ethyl)-[1,3,4]oxadiazol-2-yl]-methyl}-2-methyl-propyl)-carbamic acid tert-butyl ester

Guidance literature:: 2-(1-methyl-1-m-tolyl-ethyl)-[1,3,4]oxadiazole; With n-butyllithium; magnesium bromide; In hexane; at -70 - -45 ℃; for 1.5h;

(S)-N-tert-butoxycarbonylvalinal; In tetrahydrofuran; hexane; at -45 - -20 ℃; Further stages.;
DOI:10.1021/jm000410y