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CS-W001157 4
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1-(4-Phenoxyphenyl)propan-1-one

  • CAS No. 889-26-9

  • Cat. No. CS-0250811
  • Molecule weight226.27
  • Purity≥95%
  • MDL No.None

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

1-(4-Phenoxyphenyl)propan-1-one|CS-0250811

Structure of 889-26-9

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General Information

  • CAS No. 889-26-9
  • Cat. No. CS-0250811
  • Purity ≥95%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₁₄O₂
  • Molecular Weight 226.27
  • Synonym(s) 4-phenoxypropiophenone
  • SMILES CCC(C1=CC=C(OC2=CC=CC=C2)C=C1)=O

Synthesis

  • Route1

    References

    • Dimmock, Jonathan R.; Puthucode, Ramanan N.; Smith, Jennifer M.; Hetherington, Mark; Quail, J. Wilson; Pugazhenthi, Uma; Lechler, Terry; Stables, James P. Journal of Medicinal Chemistry, 1996 , vol. 39, # 20 p. 3984 - 3997
  • Route2
    • 1-(4-Fluorophenyl)prop-2-en-1-ol|CS-0267097
      5724-03-8
    • null|null
      108-95-2
    • ~59%
    • 1-(4-Phenoxyphenyl)propan-1-one|CS-0250811
      889-26-9

    References

    • Watson, Andrew J. A.; Atkinson, Benjamin N.; Maxwell, Aoife C.; Williams, Jonathan M. J. Advanced Synthesis and Catalysis, 2013 , vol. 355, # 4 p. 734 - 740
  • Route3

    References

    • Watanabe, Kazutoshi; Morinaka, Yasuhiro; Hayashi, Yoshio; Shinoda, Masaki; Nishi, Hiroyoshi; Fukushima, Nobuko; Watanabe, Toshiaki; Ishibashi, Akira; Yuki, Satoshi; Tanaka, Masahiko Bioorganic and Medicinal Chemistry Letters, 2008 , vol. 18, # 4 p. 1478 - 1483

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   26.3
  • LogP   4.0716
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   4

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