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9-Benzyl-9-borabicyclo[3.3.1]nonane

Base Information Edit
  • Chemical Name:9-Benzyl-9-borabicyclo[3.3.1]nonane
  • CAS No.:53317-09-2
  • Molecular Formula:C15H21B
  • Molecular Weight:212.143
  • Hs Code.:2902909090
  • European Community (EC) Number:803-759-3
  • DSSTox Substance ID:DTXSID40399960
  • Nikkaji Number:J1.813.027K
  • Wikidata:Q72440832
  • Mol file:53317-09-2.mol
9-Benzyl-9-borabicyclo[3.3.1]nonane

Synonyms:B-benzyl-9-borabicyclo(3.3.1)nonane

Suppliers and Price of 9-Benzyl-9-borabicyclo[3.3.1]nonane
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
  • Packaging
  • price
  • Sigma-Aldrich
  • B-Benzyl-9-BBN solution 0.5 M in THF
  • 100ml
  • $ 349.00
  • American Custom Chemicals Corporation
  • BETA-BENZYL-9-BBN 95.00%
  • 5MG
  • $ 502.46
Total 29 raw suppliers
Chemical Property of 9-Benzyl-9-borabicyclo[3.3.1]nonane Edit
Chemical Property:
  • Vapor Pressure:0.000589mmHg at 25°C 
  • Refractive Index:1.518 
  • Boiling Point:320.6 °C at 760 mmHg 
  • Flash Point:147.7 °C 
  • PSA:0.00000 
  • Density:0.94 g/cm3 
  • LogP:4.63770 
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:0
  • Rotatable Bond Count:2
  • Exact Mass:212.1736308
  • Heavy Atom Count:16
  • Complexity:198
Purity/Quality:

99% *data from raw suppliers

B-Benzyl-9-BBN solution 0.5 M in THF *data from reagent suppliers

Safty Information:
  • Pictogram(s): FlammableF,IrritantXi 
  • Hazard Codes:F,Xi,Xn 
  • Statements: 11-19-36/37-40-14 
  • Safety Statements: 16-29-33-36/37-26 
MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:B1(C2CCCC1CCC2)CC3=CC=CC=C3
Technology Process of 9-Benzyl-9-borabicyclo[3.3.1]nonane

There total 5 articles about 9-Benzyl-9-borabicyclo[3.3.1]nonane 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:
In diethyl ether; at -78 - 20 ℃;
DOI:10.1021/ja074110i
Guidance literature:
Multi-step reaction with 2 steps
1.1: potassium peroxomonosulfate / methanol; water / 12 h / 0 - 20 °C / Inert atmosphere
2.1: n-butyllithium / tetrahydrofuran; hexane / 0.5 h / -78 - 0 °C / Inert atmosphere
2.2: 0 - 20 °C / Inert atmosphere
With n-butyllithium; potassium peroxomonosulfate; In tetrahydrofuran; methanol; hexane; water;
DOI:10.1021/ol300672q
Guidance literature:
Multi-step reaction with 3 steps
1.1: potassium carbonate / N,N-dimethyl-formamide / 80 °C / Inert atmosphere
2.1: potassium peroxomonosulfate / methanol; water / 12 h / 0 - 20 °C / Inert atmosphere
3.1: n-butyllithium / tetrahydrofuran; hexane / 0.5 h / -78 - 0 °C / Inert atmosphere
3.2: 0 - 20 °C / Inert atmosphere
With n-butyllithium; potassium peroxomonosulfate; potassium carbonate; In tetrahydrofuran; methanol; hexane; water; N,N-dimethyl-formamide;
DOI:10.1021/ol300672q
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