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3-Cyanocoumarin

Base Information Edit
  • Chemical Name:3-Cyanocoumarin
  • CAS No.:15119-34-3
  • Molecular Formula:C10H5NO2
  • Molecular Weight:171.155
  • Hs Code.:2932209090
  • European Community (EC) Number:681-439-0
  • DSSTox Substance ID:DTXSID10164728
  • Nikkaji Number:J736.548I
  • Wikidata:Q83033800
  • Metabolomics Workbench ID:74175
  • ChEMBL ID:CHEMBL1767304
  • Mol file:15119-34-3.mol
3-Cyanocoumarin

Synonyms:3-cyanocoumarin

Suppliers and Price of 3-Cyanocoumarin
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
  • TRC
  • 3-Cyanocoumarin
  • 50mg
  • $ 60.00
  • TCI Chemical
  • Coumarin-3-carbonitrile >98.0%(GC)
  • 1g
  • $ 31.00
  • TCI Chemical
  • Coumarin-3-carbonitrile >98.0%(GC)
  • 5g
  • $ 114.00
  • Sigma-Aldrich
  • 3-Cyanocoumarin 97%
  • 1g
  • $ 41.80
  • Heterocyclics
  • 3-Cyanocoumarin 97%
  • 5g
  • $ 95.00
  • Heterocyclics
  • 3-Cyanocoumarin 97%
  • 25g
  • $ 294.00
  • Crysdot
  • 2-Oxo-2H-chromene-3-carbonitrile 95+%
  • 25g
  • $ 356.00
  • Chemenu
  • 2-Oxo-2H-chromene-3-carbonitrile 95%
  • 25g
  • $ 337.00
  • Biosynth Carbosynth
  • 3-Cyanocoumarin
  • 2 g
  • $ 60.00
  • Biosynth Carbosynth
  • 3-Cyanocoumarin
  • 5 g
  • $ 100.00
Total 27 raw suppliers
Chemical Property of 3-Cyanocoumarin Edit
Chemical Property:
  • Vapor Pressure:4.32E-05mmHg at 25°C 
  • Melting Point:184-188 °C(lit.) 
  • Refractive Index:1.621 
  • Boiling Point:350.7 °C at 760 mmHg 
  • Flash Point:167.2 °C 
  • PSA:54.00000 
  • Density:1.34 g/cm3 
  • LogP:1.66468 
  • XLogP3:1.8
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:3
  • Rotatable Bond Count:0
  • Exact Mass:171.032028402
  • Heavy Atom Count:13
  • Complexity:310
Purity/Quality:

97% *data from raw suppliers

3-Cyanocoumarin *data from reagent suppliers

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

Total 1 MSDS from other Authors

Useful:
  • Canonical SMILES:C1=CC=C2C(=C1)C=C(C(=O)O2)C#N
Technology Process of 3-Cyanocoumarin

There total 40 articles about 3-Cyanocoumarin 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 zirconyl chloride octahydrate; sodium amide; In tetrahydrofuran; at 25 ℃; for 0.5h; Green chemistry;
DOI:10.14233/ajchem.2020.22849
Guidance literature:
With 2,4,6-tripropyl-1,3,5,2,4,6-trioxatriphosphinane-2,4,6-trioxide; triethylamine; In acetic acid butyl ester; ethyl acetate; at 120 ℃;
DOI:10.1016/j.tetlet.2012.06.037
Guidance literature:
salicylaldehyde; malononitrile; With silicium tetrachloride; In ethanol; at 20 ℃; for 0.25h;
With water monomer; In ethanol; Cooling with ice;
DOI:10.3998/ark.5550190.0013.921
Refernces Edit
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