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CS-W001157 4
Total: USD 88.00

1-(3-Chloropropoxy)-4-nitrobenzene

  • CAS No. 79096-54-1

  • Cat. No. CS-0248426
  • Purity≥98%
  • MDL No.None

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

1-(3-Chloropropoxy)-4-nitrobenzene|CS-0248426

Structure of 79096-54-1

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General Information

  • CAS No. 79096-54-1
  • Cat. No. CS-0248426
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₀ClNO₃
  • Molecular Weight 215.63
  • Synonym(s) None
  • SMILES O=[N+](C1=CC=C(OCCCCl)C=C1)[O-]

Synthesis

  • Route1
    • null|null
      100-02-7
    • null|null
      109-70-6
    • ~97%
    • 1-(3-Chloropropoxy)-4-nitrobenzene|CS-0248426
      79096-54-1

    References

    • Aslanian, Robert; Zhu, Xiaohong; Vaccaro, Henry A.; Shih, Neng-Yang; Piwinski, John J.; Williams, Shirley M.; West Jr., Robert E. Bioorganic and Medicinal Chemistry Letters, 2008 , vol. 18, # 18 p. 5032 - 5036
  • Route2
    • null|null
      107167-08-8
    • null|null
      88-75-5
    • ~%
    • 1-(3-Chloropropoxy)-4-nitrobenzene|CS-0248426
      79096-54-1

    References

    • AMGEN INC. Patent: WO2005/21551 A1, 2005 ; Location in patent: Page/Page column 57 ;
  • Route3

    References

    • American Home Products Corporation Patent: US5104892 A1, 1992 ;

Safety Information

Download SDS
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   52.37
  • LogP   2.6025
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   5

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