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CS-W001157 4
Total: USD 88.00

2,2-Dibromo-1-(4-nitrophenyl)ethan-1-one

  • CAS No. 21566-36-9

  • Cat. No. CS-0550801
  • Purity≥98%
  • MDL No.None

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

2,2-Dibromo-1-(4-nitrophenyl)ethan-1-one|CS-0550801

Structure of 21566-36-9

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General Information

  • CAS No. 21566-36-9
  • Cat. No. CS-0550801
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₅Br₂NO₃
  • Molecular Weight 322.94
  • Synonym(s) 2,2-Dibromo-1-(4-nitrophenyl)ethanone
  • SMILES C1=CC(=CC=C1C(=O)C(Br)Br)[N+](=O)[O-]

Synthesis

  • Route1
    • null|null
      100-12-9
    • ~60%
    • 2,2-Dibromo-1-(4-nitrophenyl)ethan-1-one|CS-0550801
      21566-36-9

    References

    • Tada, Norihiro; Ban, Kazunori; Ishigami, Takafumi; Nobuta, Tomoya; Miura, Tsuyoshi; Itoh, Akichika Tetrahedron Letters, 2011 , vol. 52, # 29 p. 3821 - 3824
  • Route2
    • p-Nitrophenyl methyl ketone Clenbuterol  Impurity|CS-0229063
      100-19-6
    • ~93%
    • 2,2-Dibromo-1-(4-nitrophenyl)ethan-1-one|CS-0550801
      21566-36-9

    References

    • Paul, Satya; Gupta, Varinder; Gupta, Rajive; Loupy, Andre Tetrahedron Letters, 2003 , vol. 44, # 3 p. 439 - 442
  • Route3

    References

    • Mohan Reddy, Bodireddy; Venkata Ramana Kumar, Velpula; Chinna Gangi Reddy, Nallagondu; Mahender Rao, Siripragada Chinese Chemical Letters, 2014 , vol. 25, # 1 p. 179 - 182

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

Quality Control

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Computational Chemistry Data

  • TPSA   60.21
  • LogP   2.8934
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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