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

  • CAS No. 30879-49-3

  • Cat. No. CS-0314941
  • Molecule weight181.15
  • Purity≥98%
  • MDL No.None

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

1-(5-Hydroxy-2-nitrophenyl)ethan-1-one|CS-0314941

Structure of 30879-49-3

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General Information

  • CAS No. 30879-49-3
  • Cat. No. CS-0314941
  • Purity ≥98%
  • MDL No. None
  • Storage RT, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₇NO₄
  • Molecular Weight 181.15
  • Synonym(s) 1-(5-Hydroxy-2-nitrophenyl)ethanone
  • SMILES CC(=O)C1=C(C=CC(=C1)O)[N+](=O)[O-]

Synthesis

  • Route1

    References

    • Wang, Jingjing; Chen, Weiqiang; Zuo, Sujing; Liu, Lu; Zhang, Xinrui; Wang, Jianhui Angewandte Chemie - International Edition, 2012 , vol. 51, # 49 p. 12334 - 12338 Angew. Chem., 2012 , vol. 124, # 49 p. 12500 - 12504,5
  • Route2
    • null|null
      1392043-83-2
    • ~75%
    • In-stock
      1-(5-Hydroxy-2-nitrophenyl)ethan-1-one|CS-0314941
      30879-49-3

    References

    • Griffin, Donald R.; Kasko, Andrea M. Journal of the American Chemical Society, 2012 , vol. 134, # 31 p. 13103 - 13107
  • Route3

    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

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
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   80.44
  • LogP   1.503
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   2

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