1-(1-Azidoethenyl)-4-methylbenzene

Base Information

• Chemical Name: 1-(1-Azidoethenyl)-4-methylbenzene
• CAS No.: 89108-49-6
• Molecular Formula: C9H9N3
• Molecular Weight: 159.191
• DSSTox Substance ID: DTXSID10520249
• Nikkaji Number: J3.526.878B
• Wikidata: Q82384025
• Mol file: 89108-49-6.mol

Synonyms:1-(1-Azidoethenyl)-4-methylbenzene;89108-49-6;Benzene, 1-(1-azidoethenyl)-4-methyl-;4-(1-Azidovinyl)toluene;SCHEMBL26817863;DTXSID10520249;MFCD24452529;SY318727

Chemical Property of 1-(1-Azidoethenyl)-4-methylbenzene

Chemical Property:

• XLogP3: 3.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 159.079647300
• Heavy Atom Count: 12
• Complexity: 208

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)C(=C)N=[N+]=[N-]

Technology Process of 1-(1-Azidoethenyl)-4-methylbenzene

There total 7 articles about 1-(1-Azidoethenyl)-4-methylbenzene 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: 89.0%

4-n-methylphenylacetylene (766-97-2) → 1-(1-azidovinyl)-4-methyl benzene (89108-49-6)

Guidance literature:

With silver(I) azide; trimethylsilylazide; water; In dimethyl sulfoxide; at 80 ℃; Reagent/catalyst; Solvent;

DOI:10.1021/jacs.0c00836

Reference yield: 89.0%

1-(1,2-dibromoethyl)-4-methylbenzene (33458-08-1) → 1-(1-azidovinyl)-4-methyl benzene (89108-49-6)

Guidance literature:

With sodium azide; In N,N-dimethyl-formamide; at 20 ℃; for 24h;

DOI:10.1021/jo5021618

Reference yield: 83.0%

1-(1-azido-2-iodoethyl)-4-methylbenzene (1092459-96-5) → 1-(1-azidovinyl)-4-methyl benzene (89108-49-6)

Guidance literature:

With potassium tert-butylate; In tetrahydrofuran; at 20 ℃; for 2h; Inert atmosphere;

DOI:10.1039/c6ob00532b

upstream raw materials:

4-n-methylphenylacetylene

1-ethenyl-4-methylbenzene

1-(1-azido-2-iodoethyl)-4-methylbenzene

1-(1,2-dibromoethyl)-4-methylbenzene

Downstream raw materials:

ethyl 2-methyl-5-p-tolyl-1H-pyrrole-3-carboxylate

1-(2-methyl-5-p-tolyl-1H-pyrrol-3-yl)ethanone

6-p-tolylpiperidin-2-one

2-para-tolylimidazo[1,2-a]pyridine