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CS-W001157 4
Total: USD 88.00

1-(Benzyloxy)-2-chloro-4-nitrobenzene

  • CAS No. 50508-54-8

  • Cat. No. CS-0215611
  • Purity95+%
  • MDL No.None

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

1-(Benzyloxy)-2-chloro-4-nitrobenzene|CS-0215611

Structure of 50508-54-8

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General Information

  • CAS No. 50508-54-8
  • Cat. No. CS-0215611
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₀ClNO₃
  • Molecular Weight 263.68
  • Synonym(s) 4-Benzyloxy-3-chloronitrobenzene
  • SMILES O=[N+](C1=CC=C(OCC2=CC=CC=C2)C(Cl)=C1)[O-]

Synthesis

  • Route1

    References

    • BAYER PHARMACEUTICALS CORPORATION; ZHANG, Chengzhi Patent: WO2006/23843 A2, 2006 ; Location in patent: Page/Page column 77 ;
  • Route2

    References

    • WYETH Patent: US2006/270668 A1, 2006 ; Location in patent: Page/Page column 16 ;
  • Route3
    • null|null
      38731-70-3
    • null|null
      100-44-7
    • ~88%
    • 1-(Benzyloxy)-2-chloro-4-nitrobenzene|CS-0215611
      50508-54-8

    References

    • Capps, David B.; Dunbar, James; Kesten, Suzanne R.; Shillis, Joan; Werbel, Leslie M.; et al. Journal of Medicinal Chemistry, 1992 , vol. 35, # 26 p. 4770 - 4778

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

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Computational Chemistry Data

  • TPSA   52.37
  • LogP   3.8272
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   4

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