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5-Ethynyl-2-methoxybenzonitrile

Base Information Edit
  • Chemical Name:5-Ethynyl-2-methoxybenzonitrile
  • CAS No.:1062617-60-0
  • Molecular Formula:C10H7NO
  • Molecular Weight:157.172
  • Hs Code.:2926909090
  • DSSTox Substance ID:DTXSID80700112
  • Wikidata:Q82631297
  • Mol file:1062617-60-0.mol
5-Ethynyl-2-methoxybenzonitrile

Synonyms:5-ETHYNYL-2-METHOXYBENZONITRILE;1062617-60-0;5-Ethynyl-2-methoxy-benzonitrile;SCHEMBL2793117;DTXSID80700112;QTFIKBPSOBAGBW-UHFFFAOYSA-N;FT-0760099;A1-00805

Suppliers and Price of 5-Ethynyl-2-methoxybenzonitrile
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
  • Matrix Scientific
  • 5-Ethynyl-2-methoxybenzonitrile
  • 5g
  • $ 1920.00
  • Matrix Scientific
  • 5-Ethynyl-2-methoxybenzonitrile
  • 1g
  • $ 720.00
  • Crysdot
  • 5-Ethynyl-2-methoxybenzonitrile 95+%
  • 1g
  • $ 713.00
  • Crysdot
  • 5-Ethynyl-2-methoxybenzonitrile 95+%
  • 5g
  • $ 1905.00
  • A1 Biochem Labs
  • 5-Ethynyl-2-methoxybenzonitrile 95%
  • 5 g
  • $ 1200.00
  • A1 Biochem Labs
  • 5-Ethynyl-2-methoxybenzonitrile 95%
  • 1 g
  • $ 450.00
Total 5 raw suppliers
Chemical Property of 5-Ethynyl-2-methoxybenzonitrile Edit
Chemical Property:
  • PSA:33.02000 
  • LogP:1.54818 
  • XLogP3:1.9
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:2
  • Rotatable Bond Count:2
  • Exact Mass:157.052763847
  • Heavy Atom Count:12
  • Complexity:241
Purity/Quality:

98%min *data from raw suppliers

5-Ethynyl-2-methoxybenzonitrile *data from reagent suppliers

Safty Information:
  • Pictogram(s):  
  • Hazard Codes: 
MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:COC1=C(C=C(C=C1)C#C)C#N
Technology Process of 5-Ethynyl-2-methoxybenzonitrile

There total 1 articles about 5-Ethynyl-2-methoxybenzonitrile 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 caesium carbonate; In dichloromethane; for 2h;
Guidance literature:
(trifluoromethyl)trimethylsilane; With copper(l) iodide; N,N,N,N,-tetramethylethylenediamine; oxygen; potassium carbonate; In N,N-dimethyl-formamide; at 20 ℃; for 1.5h;
5-ethynyl-2-methoxybenzonitrile; In N,N-dimethyl-formamide; at 0 - 20 ℃; for 24h;
DOI:10.1002/adsc.201700122
Guidance literature:
Multi-step reaction with 3 steps
1.1: copper(l) iodide; N,N,N,N,-tetramethylethylenediamine; potassium carbonate; oxygen / N,N-dimethyl-formamide / 1.5 h / 20 °C
1.2: 24 h / 0 - 20 °C
2.1: copper diacetate / methanol / 3 h / 28 °C / Inert atmosphere
3.1: MoCl2O2(dmf)2; triphenylphosphine / toluene / 3 h / -78 - 80 °C / Inert atmosphere
With copper(l) iodide; N,N,N,N,-tetramethylethylenediamine; MoCl2O2(dmf)2; oxygen; copper diacetate; potassium carbonate; triphenylphosphine; In methanol; N,N-dimethyl-formamide; toluene; 3.1: |Cadogan-Cameron Wood Cyclization;
DOI:10.1002/adsc.201700122
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