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CS-W001157 4
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Diethyl 2-(((2-(trifluoromethyl)phenyl)amino)methylene)malonate

  • CAS No. 23779-94-4

  • Cat. No. CS-0582371
  • Purity≥98%
  • MDL No.None

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

Diethyl 2-(((2-(trifluoromethyl)phenyl)amino)methylene)malonate|CS-0582371

Structure of 23779-94-4

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General Information

  • CAS No. 23779-94-4
  • Cat. No. CS-0582371
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₁₆F₃NO₄
  • Molecular Weight 331.29
  • Synonym(s) Diethyl 2-[[2-(trifluoromethyl)anilino]methylidene]propanedioate
  • SMILES CCOC(=O)C(=CNC1=CC=CC=C1C(F)(F)F)C(=O)OCC

Synthesis

  • Route1

    References

    • Thomas; Adhikari, Airody Vasudeva; Telkar, Sandeep; Chowdhury, Imran H.; Mahmood, Riaz; Pal, Nishith K.; Row, Guru; Sumesh European Journal of Medicinal Chemistry, 2011 , vol. 46, # 11 p. 5283 - 5292

Safety Information

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

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Computational Chemistry Data

  • TPSA   64.63
  • LogP   3.1274
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   6

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