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CS-W001157 4
Total: USD 88.00

1-(2-Methoxy-5-nitrophenyl)ethan-1-one

  • CAS No. 61941-46-6

  • Cat. No. CS-0272046
  • Purity≥98%
  • MDL No.None

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

1-(2-Methoxy-5-nitrophenyl)ethan-1-one|CS-0272046

Structure of 61941-46-6

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General Information

  • CAS No. 61941-46-6
  • Cat. No. CS-0272046
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₉NO₄
  • Molecular Weight 195.17
  • Synonym(s) 2-Methoxy-5-Nitroacetophenone
  • SMILES CC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])OC

Synthesis

  • Route1
    • null|null
      90763-46-5
    • ~69%
    • 1-(2-Methoxy-5-nitrophenyl)ethan-1-one|CS-0272046
      61941-46-6

    References

    • F2G LTD Patent: WO2006/123145 A1, 2006 ; Location in patent: Page/Page column 62 ;
  • Route2

    References

    • Zhong, Zhenlin; Snowden, Timothy S.; Best, Michael D.; Anslyn, Eric V. Journal of the American Chemical Society, 2004 , vol. 126, # 11 p. 3488 - 3495
  • Route3

    References

    • Asahi Kasei Kogyo Kabushiki Kaisha Patent: US6037362 A1, 2000 ;

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   69.44
  • LogP   1.806
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   3

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