5-(2,6-Dichlorophenyl)-1-methyl-1H-tetrazole

Base Information

Chemical Name:5-(2,6-Dichlorophenyl)-1-methyl-1H-tetrazole
CAS No.:77455-48-2
Molecular Formula:C₈H₆Cl₂N₄
Molecular Weight:229.068
Hs Code.:
DSSTox Substance ID:DTXSID80506398
Wikidata:Q82362114

Synonyms:5-(2,6-Dichlorophenyl)-1-methyl-1H-tetrazole;77455-48-2;DTXSID80506398

Suppliers and Price of 5-(2,6-Dichlorophenyl)-1-methyl-1H-tetrazole

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
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price

Total 0 raw suppliers

Chemical Property of 5-(2,6-Dichlorophenyl)-1-methyl-1H-tetrazole

Chemical Property:

Melting Point:74-75 °C
Boiling Point:382.8±52.0 °C(Predicted)
PSA：43.60000
Density:1.55±0.1 g/cm3(Predicted)
LogP:2.18390
XLogP3:2.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:227.9969516
Heavy Atom Count:14
Complexity:194

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1C(=NN=N1)C2=C(C=CC=C2Cl)Cl

Technology Process of 5-(2,6-Dichlorophenyl)-1-methyl-1H-tetrazole

There total 2 articles about 5-(2,6-Dichlorophenyl)-1-methyl-1H-tetrazole 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: 45.05%

: 50907-31-8
2,6-dichloro-5-phenyl-1H-tetrazole

: 74-88-4
methyl iodide

: 77455-47-1
5-(2,6-dichlorophenyl)-2-methyltetrazole

: 77455-48-2
5-(2,6-dichlorophenyl)-1-methyltetrazole

Guidance literature:: With sodium hydroxide; In ethanol; water; for 12h; Heating;
DOI:10.1039/P19810000390

Reference yield:

: 1194-65-6
2,6-dichloro-benzonitrile

: 77455-48-2
5-(2,6-dichlorophenyl)-1-methyltetrazole

Guidance literature:: Multi-step reaction with 2 steps

1: 69 percent / sodium azide / butan-1-ol; acetic acid / 120 h / Heating

2: 45.05 percent / sodium hydroxide / ethanol; H₂O / 12 h / Heating

With sodium hydroxide; sodium azide; In ethanol; water; acetic acid; butan-1-ol;
DOI:10.1039/P19810000390