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Hexabutylbenzene

Base Information Edit
  • Chemical Name:Hexabutylbenzene
  • CAS No.:106821-88-9
  • Molecular Formula:C30H54
  • Molecular Weight:414.759
  • Hs Code.:
  • DSSTox Substance ID:DTXSID40503489
  • Nikkaji Number:J1.812.003H
  • Wikidata:Q82357360
  • Mol file:106821-88-9.mol
Hexabutylbenzene

Synonyms:hexabutylbenzene;106821-88-9;DTXSID40503489

Suppliers and Price of Hexabutylbenzene
Supply Marketing:Edit
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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Total 0 raw suppliers
Chemical Property of Hexabutylbenzene Edit
Chemical Property:
  • XLogP3:13.2
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:0
  • Rotatable Bond Count:18
  • Exact Mass:414.422551722
  • Heavy Atom Count:30
  • Complexity:267
Purity/Quality:
Safty Information:
  • Pictogram(s):  
  • Hazard Codes: 
MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:CCCCC1=C(C(=C(C(=C1CCCC)CCCC)CCCC)CCCC)CCCC
Technology Process of Hexabutylbenzene

There total 3 articles about Hexabutylbenzene 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:
Guidance literature:
With palladium on activated charcoal; chloro-trimethyl-silane; In tetrahydrofuran; for 6h; Heating;
DOI:10.1021/jo00382a039
Guidance literature:
5-decyne; With titanocene dichloride; diethylaluminium chloride; magnesium; In tetrahydrofuran; at 21 - 22 ℃; for 8h;
With diclazuril; In tetrahydrofuran; water-d2;
DOI:10.1023/A:1025697110484
Guidance literature:
With 1,3-bis-(diphenylphosphino)propane; cobalt(II) chloride; zinc powder; In 2-methyltetrahydrofuran; at 80 ℃; for 24h; Reagent/catalyst; Temperature; Solvent; Overall yield = 83 percent; stereoselective reaction;
DOI:10.1021/acscatal.2c00181
upstream raw materials:

5-decyne

benzonitrile

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