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CS-W001157 4
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Ethyl 2-(7-hydroxy-2-oxo-2h-chromen-4-yl)acetate

  • CAS No. 74083-58-2

  • Cat. No. CS-0299097
  • Purity≥95%
  • MDL No.None

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

Ethyl 2-(7-hydroxy-2-oxo-2h-chromen-4-yl)acetate|CS-0299097

Structure of 74083-58-2

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General Information

  • CAS No. 74083-58-2
  • Cat. No. CS-0299097
  • Purity ≥95%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₂O₅
  • Molecular Weight 248.23
  • Synonym(s) 2H-1-Benzopyran-4-acetic acid, 7-hydroxy-2-oxo-, ethyl ester
  • SMILES CCOC(=O)CC1=CC(=O)OC2=C1C=CC(=C2)O

Synthesis

  • Route1
    • null|null
      108-46-3
    • ~40%
    • Ethyl 2-(7-hydroxy-2-oxo-2h-chromen-4-yl)acetate|CS-0299097
      74083-58-2

    References

    • NEWRON PHARMACEUTICALS S.P.A. Patent: WO2006/102958 A1, 2006 ; Location in patent: Page/Page column 31 ; WO 2006/102958 A1
  • Route2

    References

    • Garcia-Beltran, Olimpo; Cassels, Bruce K.; Mena, Natalia; Nunez, Marco T.; Berrios, Tania A.; Castro, Enrique A.; Aliaga, Margarita E. Tetrahedron Letters, 2012 , vol. 53, # 48 p. 6598 - 6601,4
  • Route3

    References

    • Azizian, Javad; Mohammadi, Ali A.; Bidar, Ilyar; Mirzaei, Peiman Monatshefte fur Chemie, 2008 , vol. 139, # 7 p. 805 - 808

Safety Information

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GHS Pictogram : N/A
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Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   76.74
  • LogP   1.6042
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   3

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