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CS-W001157 4
Total: USD 88.00

2-Morpholino-5-nitrobenzotrifluoride

  • CAS No. 54672-11-6

  • Cat. No. CS-0208391
  • Molecule weight276.21
  • Purity≥97%
  • MDL No.MFCD00100093

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

2-Morpholino-5-nitrobenzotrifluoride|CS-0208391

Structure of 54672-11-6

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General Information

  • CAS No. 54672-11-6
  • Cat. No. CS-0208391
  • Purity ≥97%
  • MDL No. MFCD00100093
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₁F₃N₂O₃
  • Molecular Weight 276.21
  • Synonym(s) 4-[4-Nitro-2-(trifluoromethyl)phenyl]morpholine
  • SMILES C1=C(C=C(C(=C1)N2CCOCC2)C(F)(F)F)[N+](=O)[O-]

Synthesis

  • Route1

    References

    • SUNSHINE LAKE PHARMA CO., LTD.; ZHANG, Yingjun; ZHANG, Jiancun; WANG, Xiaojun; LIN, Runfeng; CAO, Shengtian; WANG, Zhaohe; LI, Jing Patent: WO2014/12360 A1, 2014 ; Location in patent: Paragraph 00462 ;
  • Route2

    References

    • Hepworth,J.D. et al. Synthesis, 1974 , p. 874 - 876

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
Precautionary Statements : P264-P270-P280-P302+P352-P330-P362+P364-P501

Quality Control

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Computational Chemistry Data

  • TPSA   55.61
  • LogP   2.4502
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   2

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