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CS-W001157 4
Total: USD 88.00

1-Nitro-4-(2,2,2-trifluoroethyl)benzene

  • CAS No. 3764-36-1

  • Cat. No. CS-0268066
  • Purity≥97%
  • MDL No.None

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

1-Nitro-4-(2,2,2-trifluoroethyl)benzene|CS-0268066

Structure of 3764-36-1

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General Information

  • CAS No. 3764-36-1
  • Cat. No. CS-0268066
  • Purity ≥97%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₆F₃NO₂
  • Molecular Weight 205.13
  • Synonym(s) 1-(2,2,2-trifluoroethyl)-4-nitrobenzene
  • SMILES C1=C(C=CC(=C1)[N+](=O)[O-])CC(F)(F)F

Synthesis

  • Route1
    • 1-(Iodomethyl)-4-nitrobenzene|CS-0438606
      3145-86-6
    • In-stock
      (Trifluoromethyl)trimethylsilane|CS-0008418
      81290-20-2
    • ~58%
    • In-stock
      1-Nitro-4-(2,2,2-trifluoroethyl)benzene|CS-0268066
      3764-36-1

    References

    • Kremlev, Mikhail M.; Mushta, Aleksej I.; Tyrra, Wieland; Yagupolskii, Yurii L.; Naumann, Dieter; Moeller, Angela Journal of Fluorine Chemistry, 2012 , vol. 133, p. 67 - 71
  • Route2

    References

    • Thomoson, Charles S.; Martinez, Henry; Dolbier Jr., William R. Journal of Fluorine Chemistry, 2013 , vol. 150, p. 53 - 59
  • Route3
    • In-stock
      5-(Trifluoromethyl)-5H-dibenzo[b,d]thiophen-5-ium trifluoromethanesulfonate|CS-W007716
      129946-88-9
    • null|null
      100-11-8
    • ~52%
    • In-stock
      1-Nitro-4-(2,2,2-trifluoroethyl)benzene|CS-0268066
      3764-36-1

    References

    • Kawai, Hiroyuki; Furukawa, Tatsuya; Nomura, Yoshinori; Tokunaga, Etsuko; Shibata, Norio Organic Letters, 2011 , vol. 13, # 14 p. 3596 - 3599

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H320
Precautionary Statements : P264-P280-P302+P352-P305+P351+P338-P362

Quality Control

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Computational Chemistry Data

  • TPSA   43.14
  • LogP   2.6996
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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