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CS-W001157 4
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6-Ethyl-4-oxo-4H-chromene-3-carbonitrile

  • CAS No. 50743-19-6

  • Cat. No. CS-0558795
  • Molecule weight199.21
  • Purity≥98%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

6-Ethyl-4-oxo-4H-chromene-3-carbonitrile|CS-0558795

Structure of 50743-19-6

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General Information

  • CAS No. 50743-19-6
  • Cat. No. CS-0558795
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₉NO₂
  • Molecular Weight 199.21
  • Synonym(s) 3-Cyano-6-ethylchromone
  • SMILES CCC1=CC2=C(C=C1)OC=C(C2=O)C#N

Synthesis

  • Route1
    • 6-Ethyl-4-oxo-4h-chromene-3-carbaldehyde|CS-0296729
      42059-78-9
    • ~74%
    • 6-Ethyl-4-oxo-4H-chromene-3-carbonitrile|CS-0558795
      50743-19-6

    References

    • Jagath Reddy; Latha; Thirupathaiah; Srinivasa Rao Organic Preparations and Procedures International, 2004 , vol. 36, # 3 p. 287 - 289
  • Route2
    • 6-Ethyl-4-oxo-4h-chromene-3-carbaldehyde|CS-0296729
      42059-78-9
    • ~%
    • 6-Ethyl-4-oxo-4H-chromene-3-carbonitrile|CS-0558795
      50743-19-6
    • null|null
      53658-18-7

    References

    • Noharta,A. Tetrahedron Letters, 1974 , p. 1187 - 1190

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H320
Precautionary Statements : P264-P280-P302+P352-P305+P351+P338-P362

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Computational Chemistry Data

  • TPSA   54
  • LogP   2.22708
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

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