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CS-W001157 4
Total: USD 88.00

1-Nitro-2-(2,2,2-trifluoroethoxy)benzene

  • CAS No. 87014-28-6

  • Cat. No. CS-0207303
  • Purity≥98%
  • MDL No.MFCD00077607

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

1-Nitro-2-(2,2,2-trifluoroethoxy)benzene|CS-0207303

Structure of 87014-28-6

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General Information

  • CAS No. 87014-28-6
  • Cat. No. CS-0207303
  • Purity ≥98%
  • MDL No. MFCD00077607
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₆F₃NO₃
  • Molecular Weight 221.13
  • Synonym(s) Benzene, 1-nitro-2-(2,2,2-trifluoroethoxy)-
  • SMILES C1=CC=C(C(=C1)[N+](=O)[O-])OCC(F)(F)F

Synthesis

  • Route1
    • null|null
      6226-25-1
    • null|null
      88-75-5
    • ~98%
    • In-stock
      1-Nitro-2-(2,2,2-trifluoroethoxy)benzene|CS-0207303
      87014-28-6

    References

    • BIOGEN IDEC MA INC.; CHAO, Jianhua; ENYEDY, Istvan, J.; GUERTIN, Kevin; HUTCHINGS, Richard, H.; JONES, John, Howard; POWELL, Noel; VANVLOTEN, Kurt, D. Patent: WO2014/8214 A1, 2014 ; Location in patent: Paragraph 00500-00501 ;
  • Route2
    • null|null
      75-89-8
    • null|null
      88-73-3
    • ~88%
    • In-stock
      1-Nitro-2-(2,2,2-trifluoroethoxy)benzene|CS-0207303
      87014-28-6

    References

    • KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY Patent: EP966466 B1, 2002 ;
  • Route3
    • null|null
      75-89-8
    • null|null
      528-29-0
    • ~73%
    • In-stock
      1-Nitro-2-(2,2,2-trifluoroethoxy)benzene|CS-0207303
      87014-28-6

    References

    • Tejero, Ismael; Huertas, Imma; Gonzalez-Lafont, Angels; Lluch, Jose M.; Marquet, Jordi Journal of Organic Chemistry, 2005 , vol. 70, # 5 p. 1718 - 1727

Safety Information

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Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   52.37
  • LogP   2.5359
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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