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CS-W001157 4
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Ethyl 4-(naphthalen-1-yl)-3-oxobutanoate

  • CAS No. 189057-82-7

  • Cat. No. CS-0122121
  • Molecule weight256.30
  • Purity≥98%
  • MDL No.MFCD03844428

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

Ethyl 4-(naphthalen-1-yl)-3-oxobutanoate|CS-0122121

Structure of 189057-82-7

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General Information

  • CAS No. 189057-82-7
  • Cat. No. CS-0122121
  • Purity ≥98%
  • MDL No. MFCD03844428
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₆H₁₆O₃
  • Molecular Weight 256.30
  • Synonym(s) 4-NAPHTHALEN-1-YL-3-OXO-BUTYRIC ACID ETHYL ESTER
  • SMILES O=C(OCC)CC(CC1=C2C=CC=CC2=CC=C1)=O

Synthesis

  • Route1

    References

    • Shimkin; Shirinian; Mailian; Lonshakov; Gorokhov; Krayushkin Russian Chemical Bulletin, 2011 , vol. 60, # 1 p. 139 - 142
  • Route2

    References

    • Shimkin; Shirinian; Mailian; Lonshakov; Gorokhov; Krayushkin Russian Chemical Bulletin, 2011 , vol. 60, # 1 p. 139 - 142
  • Route3

    References

    • Mai, Antonello; Artico, Marino; Sbardella, Gianluca; Quartarone, Silvana; Massa, Silvio; Loi, Anna G.; De Montis, Antonella; Scintu, Franca; Putzolu, Monica; La Colla, Paolo Journal of Medicinal Chemistry, 1997 , vol. 40, # 10 p. 1447 - 1454

Safety Information

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Computational Chemistry Data

  • TPSA   43.37
  • LogP   2.9046
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   5

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