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CS-W001157 4
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1,1'-(Oxybis(4,1-phenylene))bis(2-chloroethan-1-one)

  • CAS No. 3030-53-3

  • Cat. No. CS-0575998
  • Molecule weight323.17
  • Purity≥98%
  • MDL No.None

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

1,1'-(Oxybis(4,1-phenylene))bis(2-chloroethan-1-one)|CS-0575998

Structure of 3030-53-3

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General Information

  • CAS No. 3030-53-3
  • Cat. No. CS-0575998
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₆H₁₂Cl₂O₃
  • Molecular Weight 323.17
  • Synonym(s) Clofenoxyde
  • SMILES C1=CC(=CC=C1C(=O)CCl)OC2=CC=C(C=C2)C(=O)CCl

Synthesis

  • Route1
    • null|null
      101-84-8
    • null|null
      79-04-9
    • ~69%
    • 1,1'-(Oxybis(4,1-phenylene))bis(2-chloroethan-1-one)|CS-0575998
      3030-53-3

    References

    • Ceylan, Yusuf; Usta, Ayhan; Usta, Keziban; Durmaz, Fatih; Coskun, Ahmet Journal of Molecular Structure, 2013 , vol. 1050, p. 69 - 72
  • Route2

    References

    • BRISTOL-MYERS SQUIBB COMPANY; BELEMA, Makonen; HEWAWASAM, Piyasena Patent: WO2012/39717 A1, 2012 ; Location in patent: Page/Page column 51-52 ;

Safety Information

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Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   43.37
  • LogP   4.3219
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   6

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