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CS-W001157 4
Total: USD 88.00

1-(9,10-Dihydrophenanthren-2-yl)ethan-1-one

  • CAS No. 5329-89-5

  • Cat. No. CS-0550556
  • Purity≥98%
  • MDL No.None

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

1-(9,10-Dihydrophenanthren-2-yl)ethan-1-one|CS-0550556

Structure of 5329-89-5

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General Information

  • CAS No. 5329-89-5
  • Cat. No. CS-0550556
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₆H₁₄O
  • Molecular Weight 222.28
  • Synonym(s) 1-(9,10-Dihydrophenanthren-2-yl)ethanone
  • SMILES CC(=O)C1=CC2=C(C=C1)C3=CC=CC=C3CC2

Synthesis

  • Route1
    • 9,10-Dihydrophenanthrene|CS-W017186
      776-35-2
    • null|null
      75-36-5
    • ~42%
    • 1-(9,10-Dihydrophenanthren-2-yl)ethan-1-one|CS-0550556
      5329-89-5

    References

    • INTERMUNE, INC.; BUCKMAN, Brad, O.; NICHOLAS, John, B.; EMAYAN, Kumaraswamy; SEIWERT, Scott, D. Patent: WO2013/25733 A1, 2013 ; Location in patent: Paragraph 0585 ;
  • Route2
    • null|null
      1175695-84-7
    • ~46%
    • 1-(9,10-Dihydrophenanthren-2-yl)ethan-1-one|CS-0550556
      5329-89-5

    References

    • Watanabe, Masataka; Shiine, Kodai; Ldeta, Keiko; Matsumoto, Taisuke; Thiemann, Thies Journal of Chemical Research, 2008 , # 12 p. 669 - 678
  • Route3
    • null|null
      75-15-0
    • null|null
      7446-70-0
    • 9,10-Dihydrophenanthrene|CS-W017186
      776-35-2
    • null|null
      79-03-8
    • ~%
    • 1-(9,10-Dihydrophenanthren-2-yl)ethan-1-one|CS-0550556
      5329-89-5

    References

    • Burger; Mosettig Journal of the American Chemical Society, 1936 , vol. 58, p. 1857,1859

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   17.07
  • LogP   3.6548
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   1

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