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CS-W001157 4
Total: USD 88.00

Cyclopropyl(3-nitrophenyl)methanone

  • CAS No. 5680-51-3

  • Cat. No. CS-0071836
  • Molecule weight191.19
  • Purity≥97%
  • MDL No.MFCD04114344

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

Cyclopropyl(3-nitrophenyl)methanone|CS-0071836

Structure of 5680-51-3

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General Information

  • CAS No. 5680-51-3
  • Cat. No. CS-0071836
  • Purity ≥97%
  • MDL No. MFCD04114344
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₉NO₃
  • Molecular Weight 191.19
  • Synonym(s) L3TJ AVR CNW [WLN]
  • SMILES [O-][N+](C1=CC=CC(C(C2CC2)=O)=C1)=O

Synthesis

  • Route1

    References

    • Journal of Medicinal Chemistry, , vol. 38, # 18 p. 3624 - 3637
  • Route2
    • In-stock
      Cyclopropyl(phenyl)methanone|CS-W010990
      3481-02-5
    • ~%
    • In-stock
      Cyclopropyl(3-nitrophenyl)methanone|CS-0071836
      5680-51-3
    • null|null
      153877-42-0

    References

    • EP1203770 A1, ; Page 58 ;
  • Route3
    • In-stock
      Cyclopropyl(phenyl)methanone|CS-W010990
      3481-02-5
    • ~%
    • In-stock
      Cyclopropyl(3-nitrophenyl)methanone|CS-0071836
      5680-51-3
    • null|null
      93639-12-4
    • null|null
      153877-42-0

    References

    • Journal of Medicinal Chemistry, , vol. 40, # 7 p. 1149 - 1164

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   60.21
  • LogP   2.1875
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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