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CS-W001157 4
Total: USD 88.00

4-(2-Nitrophenyl)butan-2-one

  • CAS No. 58751-62-5

  • Cat. No. CS-0154053
  • Purity≥97%
  • MDL No.MFCD11655150

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

4-(2-Nitrophenyl)butan-2-one|CS-0154053

Structure of 58751-62-5

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General Information

  • CAS No. 58751-62-5
  • Cat. No. CS-0154053
  • Purity ≥97%
  • MDL No. MFCD11655150
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₁NO₃
  • Molecular Weight 193.20
  • Synonym(s) 2-Butanone,4-(2-nitrophenyl)
  • SMILES CC(CCC1=C([N+]([O-])=O)C=CC=C1)=O

Synthesis

  • Route1
    • null|null
      274676-15-2
    • ~91%
    • 4-(2-Nitrophenyl)butan-2-one|CS-0154053
      58751-62-5

    References

    • Bunce, Richard A.; Herron, Derrick M.; Ackerman, Matthew L. Journal of Organic Chemistry, 2000 , vol. 65, # 9 p. 2847 - 2850
  • Route2
    • null|null
      598-32-3
    • null|null
      577-19-5
    • ~91%
    • 4-(2-Nitrophenyl)butan-2-one|CS-0154053
      58751-62-5

    References

    • Sauza, Alejandro; Morales-Serna, Jose Antonio; Garcia-Molina, Monica; Gavino, Ruben; Cardenas, Jorge Synthesis, 2012 , vol. 2012, # 2 p. 272 - 282
  • Route3
    • null|null
      115698-86-7
    • ~%
    • 4-(2-Nitrophenyl)butan-2-one|CS-0154053
      58751-62-5

    References

    • Cao, Jun-Jie; Zhou, Feng; Zhou, Jian Angewandte Chemie - International Edition, 2010 , vol. 49, # 29 p. 4976 - 4980

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
Precautionary Statements : P264-P270-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   60.21
  • LogP   2.1164
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   4

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