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CS-W001157 4
Total: USD 88.00

7-(Diethylamino)-2-oxochromene-3-carbonitrile

  • CAS No. 51473-74-6

  • Cat. No. CS-0061510
  • Purity≥97%
  • MDL No.None

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

7-(Diethylamino)-2-oxochromene-3-carbonitrile|CS-0061510

Structure of 51473-74-6

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General Information

  • CAS No. 51473-74-6
  • Cat. No. CS-0061510
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₁₄N₂O₂
  • Molecular Weight 242.27
  • Synonym(s) 7-(Diethylamino)coumarin-3-carbonitrile
  • SMILES CCN(CC)C1=CC2=C(C=C1)C=C(C#N)C(=O)O2

Description

7-(Diethylamino)-2-oxochromene-3-carbonitrile features a fused chromenone core with electron-rich diethylamino and electron-withdrawing cyano groups, enabling strong intramolecular charge transfer. This structural motif supports applications in fluorescent probe design and organic semiconductor development due to its tunable photophysical behavior and stability under ambient conditions.

Application

7-(Diethylamino)-2-oxochromene-3-carbonitrile serves as a versatile scaffold in synthetic organic chemistry, enabling access to functionalized chromenone derivatives through standard electrophilic and nucleophilic transformations. Its diethylamino group enhances solubility and facilitates further derivatization, while the 3-cyano and 2-oxo functionalities support diverse downstream modifications. The compound exhibits bench stability and is compatible with common purification methods, making it a practical building block for medicinal chemistry campaigns targeting kinase inhibitors and other bioactive heterocycles.

Synthesis

  • Route1
    • null|null
      23764-68-3
    • ~77%
    • In-stock
      7-(Diethylamino)-2-oxochromene-3-carbonitrile|CS-0061510
      51473-74-6

    References

    • Czerney, P.; Hartmann, H. Journal fuer Praktische Chemie (Leipzig), 1982 , vol. 324, # 1 p. 21 - 28
  • Route2
    • In-stock
      4-(Diethylamino)salicylaldehyde|CS-W010682
      17754-90-4
    • null|null
      105-56-6
    • ~93%
    • In-stock
      7-(Diethylamino)-2-oxochromene-3-carbonitrile|CS-0061510
      51473-74-6

    References

    • Girija; Naik, H.S. Bhojya; Kumar, B. Vinay; Sudhamani; Harish Letters in Organic Chemistry, 2013 , vol. 10, # 7 p. 468 - 477
  • Route3
    • In-stock
      4-(Diethylamino)salicylaldehyde|CS-W010682
      17754-90-4
    • null|null
      372-09-8
    • ~87%
    • In-stock
      7-(Diethylamino)-2-oxochromene-3-carbonitrile|CS-0061510
      51473-74-6

    References

    • Augustine, John Kallikat; Bombrun, Agnes; Ramappa, Balakrishna; Boodappa, Chandrakantha Tetrahedron Letters, 2012 , vol. 53, # 33 p. 4422 - 4425

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302+H312+H332-H315-H319
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P501

Quality Control

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Computational Chemistry Data

  • TPSA   57.24
  • LogP   2.51088
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   3

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