2-(3-Methylbenzyl)-1,3,4-oxadiazole

Base Information

Chemical Name:2-(3-Methylbenzyl)-1,3,4-oxadiazole
CAS No.:1026573-04-5
Molecular Formula:C10H10N2O
Molecular Weight:174.1992
Hs Code.:
DSSTox Substance ID:DTXSID90445648
Wikidata:Q72495012
Mol file:1026573-04-5.mol

Synonyms:2-(3-methylbenzyl)-1,3,4-oxadiazole;1026573-04-5;2-[(3-methylphenyl)methyl]-1,3,4-oxadiazole;DTXSID90445648;AKOS005145986;FT-0755708

Suppliers and Price of 2-(3-Methylbenzyl)-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-(3-METHYLBENZYL)-1,3,4-OXADIAZOLE 95.00%
5MG
$ 500.80

Total 5 raw suppliers

Chemical Property of 2-(3-Methylbenzyl)-1,3,4-oxadiazole

Chemical Property:

PSA：38.92000
Density:1.128
LogP:1.96880
XLogP3:2.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:174.079312947
Heavy Atom Count:13
Complexity:163

Purity/Quality:

97% ^*data from raw suppliers

2-(3-METHYLBENZYL)-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)CC2=NN=CO2

Technology Process of 2-(3-Methylbenzyl)-1,3,4-oxadiazole

There total 3 articles about 2-(3-Methylbenzyl)-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:

: 57676-53-6
2-(3-methylphenyl)acetylhydrazine

: 149-73-5
trimethyl orthoformate

: 1026573-04-5
2-(3-methyl-benzyl)-[1,3,4]oxadiazole

Guidance literature:: With toluene-4-sulfonic acid; at 80 - 120 ℃;
DOI:10.1021/jm000410y

Reference yield:

: 621-36-3
m-methylphenylacetic acid

: 1026573-04-5
2-(3-methyl-benzyl)-[1,3,4]oxadiazole

Guidance literature:: Multi-step reaction with 3 steps

1: chlorotrimethylsilane / 5 h / 20 °C

2: hydrazine hydrate / 28 h / Heating

3: p-toluenesulfonic acid monohydrate / 80 - 120 °C

With chloro-trimethyl-silane; toluene-4-sulfonic acid; hydrazine hydrate;
DOI:10.1021/jm000410y

Reference yield:

: 53088-69-0
methyl 3-methylphenylacetate

: 1026573-04-5
2-(3-methyl-benzyl)-[1,3,4]oxadiazole

Guidance literature:: Multi-step reaction with 2 steps

1: hydrazine hydrate / 28 h / Heating

2: p-toluenesulfonic acid monohydrate / 80 - 120 °C

With toluene-4-sulfonic acid; hydrazine hydrate;
DOI:10.1021/jm000410y