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CS-W001157 4
Total: USD 88.00

Methyl 4-(4-methoxyphenyl)-4-oxobutanoate

  • CAS No. 5447-74-5

  • Cat. No. CS-0361847
  • Purity≥97%
  • MDL No.None

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

Methyl 4-(4-methoxyphenyl)-4-oxobutanoate|CS-0361847

Structure of 5447-74-5

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General Information

  • CAS No. 5447-74-5
  • Cat. No. CS-0361847
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₄O₄
  • Molecular Weight 222.24
  • Synonym(s) Methyl 4-(4-methoxyphenyl)-4-oxobutyrate
  • SMILES COC1=CC=C(C=C1)C(=O)CCC(=O)OC

Synthesis

  • Route1

    References

    • FERRER INTERNACIONAL, S.A. Patent: EP1845098 A1, 2007 ; Location in patent: Page/Page column 26 ;
  • Route2

    References

    • Ruan, Jiwu; Saidi, Ourida; Iggo, Jonathan A.; Xiao, Jianliang Journal of the American Chemical Society, 2008 , vol. 130, # 32 p. 10510 - 10511
  • Route3
    • 4-Methoxybenzaldehyde, ≥ 99% GC|CS-0676496
      123-11-5
    • null|null
      292638-85-8
    • ~67%
    • Methyl 4-(4-methoxyphenyl)-4-oxobutanoate|CS-0361847
      5447-74-5
    • In-stock
      Anisoin|CS-0150419
      119-52-8

    References

    • Anjaiah, Siddam; Chandrasekhar, Srivari; Gree, Rene Advanced Synthesis and Catalysis, 2004 , vol. 346, # 11 p. 1329 - 1334

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   1.8311
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   5

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