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CS-W001157 4
Total: USD 88.00

Ethyl 4-(5-chloro-2-methoxyphenyl)-4-oxobutanoate

  • CAS No. 107774-17-4

  • Cat. No. CS-0586610
  • Purity≥98%
  • MDL No.None

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

Ethyl 4-(5-chloro-2-methoxyphenyl)-4-oxobutanoate|CS-0586610

Structure of 107774-17-4

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General Information

  • CAS No. 107774-17-4
  • Cat. No. CS-0586610
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₅ClO₄
  • Molecular Weight 270.71
  • Synonym(s) Benzenebutanoic acid, 5-chloro-2-methoxy-γ-oxo-, ethyl ester
  • SMILES CCOC(=O)CCC(=O)C1=C(C=CC(=C1)Cl)OC

Synthesis

  • Route1
    • null|null
      623-12-1
    • ~%
    • Ethyl 4-(5-chloro-2-methoxyphenyl)-4-oxobutanoate|CS-0586610
      107774-17-4

    References

    • Journal of the Indian Chemical Society, , vol. 35, p. 745,747
  • Route2
    • 4-(5-Chloro-2-methoxyphenyl)-4-oxobutanoic acid|CS-0695649
      63213-94-5
    • ~%
    • Ethyl 4-(5-chloro-2-methoxyphenyl)-4-oxobutanoate|CS-0586610
      107774-17-4

    References

    • Journal of the Indian Chemical Society, , vol. 35, p. 745,747
  • Route3
    • null|null
      106-48-9
    • ~%
    • Ethyl 4-(5-chloro-2-methoxyphenyl)-4-oxobutanoate|CS-0586610
      107774-17-4

    References

    • Journal of the Indian Chemical Society, , vol. 35, p. 745,747

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   52.6
  • LogP   2.8746
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   6

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