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Benzonitrile, 3-chloro-, N-oxide

Base Information Edit
  • Chemical Name:Benzonitrile, 3-chloro-, N-oxide
  • CAS No.:13820-15-0
  • Molecular Formula:C7H4ClNO
  • Molecular Weight:153.568
  • Hs Code.:
  • DSSTox Substance ID:DTXSID60445958
  • Nikkaji Number:J329.390D
  • Mol file:13820-15-0.mol
Benzonitrile, 3-chloro-, N-oxide

Synonyms:Benzonitrile, 3-chloro-, N-oxide;13820-15-0;3-Chlorobenzonitrileoxide;3-chloro-benzonitrile oxide;SCHEMBL2279899;DTXSID60445958

Suppliers and Price of Benzonitrile, 3-chloro-, N-oxide
Supply Marketing:Edit
Business phase:
The product has achieved commercial mass production*data from LookChem market partment
Manufacturers and distributors:
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Chemical Property of Benzonitrile, 3-chloro-, N-oxide Edit
Chemical Property:
  • XLogP3:1.7
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:1
  • Rotatable Bond Count:1
  • Exact Mass:152.9981414
  • Heavy Atom Count:10
  • Complexity:169
Purity/Quality:
Safty Information:
  • Pictogram(s):  
  • Hazard Codes: 
MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:C1=CC(=CC(=C1)Cl)C#[N+][O-]
Technology Process of Benzonitrile, 3-chloro-, N-oxide

There total 6 articles about Benzonitrile, 3-chloro-, N-oxide 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 N-chloro-succinimide; In chloroform; at 20 ℃; for 0.333333h;
DOI:10.1055/s-2003-44354
Guidance literature:
Multi-step reaction with 2 steps
1: hydroxylamine hydrochloride / water; ethanol
2: triethylamine; trichloroisocyanuric acid / 15 - 27 °C / Cooling with ice
With trichloroisocyanuric acid; hydroxylamine hydrochloride; triethylamine; In ethanol; water;
DOI:10.1021/jm400902y
Guidance literature:
With triethylamine; In diethyl ether; at -10 - 0 ℃; for 0.166667h;
DOI:10.1002/hlca.19910740306
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