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CS-W001157 4
Total: USD 88.00

1-Nitro-4-trifluoromethanesulfinylbenzene

  • CAS No. 394-60-5

  • Cat. No. CS-0242320
  • Purity≥97%
  • MDL No.None

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

1-Nitro-4-trifluoromethanesulfinylbenzene|CS-0242320

Structure of 394-60-5

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General Information

  • CAS No. 394-60-5
  • Cat. No. CS-0242320
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₄F₃NO₃S
  • Molecular Weight 239.17
  • Synonym(s) oxido-sulfanylidene-[4-(trifluoromethyl)phenyl]ammonium
  • SMILES C1=C(C=CC(=C1)S(=O)C(F)(F)F)[N+](=O)[O-]

Synthesis

  • Route1

    References

    • Tang, Ri-Yuan; Zhong, Ping; Lin, Qiu-Lian Journal of Fluorine Chemistry, 2007 , vol. 128, # 6 p. 636 - 640
  • Route2

    References

    • Movchun, Valeria N.; Kolomeitsev, Alexander A.; Yagupolskii, Yurii L. Journal of Fluorine Chemistry, 1995 , vol. 70, # 2 p. 255 - 258
  • Route3

    References

    • Tang, Ri-Yuan; Zhong, Ping; Lin, Qiu-Lian Journal of Fluorine Chemistry, 2007 , vol. 128, # 6 p. 636 - 640

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   60.21
  • LogP   2.2222
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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