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CS-W001157 4
Total: USD 88.00

(2S,3S,4S,5R,6S)-2-(methoxycarbonyl)-6-(2,2,2-trichloro-1-iminoethoxy)tetrahydro-2H-pyran-3,4,5-triyl triacetate

  • CAS No. 197895-54-8

  • Cat. No. CS-0536068
  • Purity≥98%
  • MDL No.None

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

(2S,3S,4S,5R,6S)-2-(methoxycarbonyl)-6-(2,2,2-trichloro-1-iminoethoxy)tetrahydro-2H-pyran-3,4,5-triyl triacetate|CS-0536068

Structure of 197895-54-8

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General Information

  • CAS No. 197895-54-8
  • Cat. No. CS-0536068
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₁₈Cl₃NO₁₀
  • Molecular Weight 478.66
  • Synonym(s) methyl (2S,3S,4S,5R,6S)-3,4,5-triacetyloxy-6-(2,2,2-trichloroethanimidoyl)oxyoxane-2-carboxylate
  • SMILES O=C(OC)[C@@H]1[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C(Cl)(Cl)Cl)=N)O1

Synthesis

  • Route1

    References

    • Jongkees, Seino A. K.; Withers, Stephen G. Journal of the American Chemical Society, 2011 , vol. 133, # 48 p. 19334 - 19337
  • Route2

    References

    • Kvaerno, Lisbet; Ritter, Tobias; Werder, Moritz; Hauser, Helmut; Carreira, Erick M. Angewandte Chemie - International Edition, 2004 , vol. 43, # 35 p. 4653 - 4656
  • Route3

    References

    • Brown, Richard T.; Scheinmann, Feodor; Stachulski, Andrew V. Journal of Chemical Research - Part S, 1997 , # 10 p. 370 - 371

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   147.51
  • LogP   1.04347
  • H_Acceptors   11
  • H_Donors   1
  • Rotatable_Bonds   5

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