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CS-W001157 4
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1-(4-(Benzyloxy)-5-methoxy-2-nitrophenyl)ethan-1-one

  • CAS No. 75665-88-2

  • Cat. No. CS-0535112
  • Molecule weight301.29
  • Purity≥98%
  • MDL No.MFCD16877536

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

1-(4-(Benzyloxy)-5-methoxy-2-nitrophenyl)ethan-1-one|CS-0535112

Structure of 75665-88-2

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General Information

  • CAS No. 75665-88-2
  • Cat. No. CS-0535112
  • Purity ≥98%
  • MDL No. MFCD16877536
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₆H₁₅NO₅
  • Molecular Weight 301.29
  • Synonym(s) 1-(4-(Benzyloxy)-5-methoxy-2-nitrophenyl)ethanone
  • SMILES CC(=O)C1=CC(=C(C=C1[N+](=O)[O-])OCC2=CC=CC=C2)OC

Synthesis

  • Route1

    References

    • Efficient Pharma Management Corporate Patent: US2012/15908 A1, 2012 ; Location in patent: Page/Page column 17 ;
  • Route2

    References

    • Mizuta, Hironori; Watanabe, Soichiro; Sakurai, Yuji; Nishiyama, Keiko; Furuta, Toshiaki; Kobayashi, Yoshiro; Iwamura, Michiko Bioorganic and Medicinal Chemistry, 2002 , vol. 10, # 3 p. 675 - 683
  • Route3
    • null|null
      100-39-0
    • ~%
    • 1-(4-(Benzyloxy)-5-methoxy-2-nitrophenyl)ethan-1-one|CS-0535112
      75665-88-2

    References

    • Umeda, Nobuhiro; Ueno, Tasuku; Pohlmeyer, Christopher; Nagano, Tetsuo; Inoue, Takanari Journal of the American Chemical Society, 2011 , vol. 133, # 1 p. 12 - 14

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319
Precautionary Statements : P264-P280-P302+P352-P362+P364

Quality Control

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Computational Chemistry Data

  • TPSA   78.67
  • LogP   3.385
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   6

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