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CS-W001157 4
Total: USD 88.00

2-Hydroxy-1-(4-methoxyphenyl)-2-phenylethanone

  • CAS No. 4254-17-5

  • Cat. No. CS-0117112
  • Molecule weight242.27
  • Purity≥98%
  • MDL No.None

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

2-Hydroxy-1-(4-methoxyphenyl)-2-phenylethanone|CS-0117112

Structure of 4254-17-5

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General Information

  • CAS No. 4254-17-5
  • Cat. No. CS-0117112
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₁₄O₃
  • Molecular Weight 242.27
  • Synonym(s) 4-Methoxybenzoin
  • SMILES COC1=CC=C(C(C(O)C2=CC=CC=C2)=O)C=C1

Synthesis

  • Route1
    • 4-Methoxybenzaldehyde, ≥ 99% GC|CS-0676496
      123-11-5
    • ~42%
    • 2-Hydroxy-1-(4-methoxyphenyl)-2-phenylethanone|CS-0117112
      4254-17-5

    References

    • American Home Products Corporation Patent: US5071988 A1, 1991 ;
  • Route2
    • null|null
      66985-48-6
    • null|null
      100-52-7
    • ~47%
    • 2-Hydroxy-1-(4-methoxyphenyl)-2-phenylethanone|CS-0117112
      4254-17-5

    References

    • BAYER SCHERING PHARMA AKTIENGESELLSCHAFT Patent: US2011/124665 A1, 2011 ; Location in patent: Page/Page column 20 ;
  • Route3
    • 1-(4-Methoxyphenyl)-2-phenylethane-1,2-dione|CS-0117108
      22711-21-3
    • ~62%
    • null|null
      1889-84-5
    • 2-Hydroxy-1-(4-methoxyphenyl)-2-phenylethanone|CS-0117112
      4254-17-5

    References

    • Heilmann, Steven M.; Rasmussen, Jerald K.; Smith, Howell K. Journal of Organic Chemistry, 1983 , vol. 48, # 7 p. 987 - 992

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

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Computational Chemistry Data

  • TPSA   46.53
  • LogP   2.6115
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   4

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