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CS-W001157 4
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Ethyl [(anilinocarbonothioyl)amino]acetate

  • CAS No. 104892-41-3

  • Cat. No. CS-0116786
  • Purity95+%
  • MDL No.None

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

Ethyl [(anilinocarbonothioyl)amino]acetate|CS-0116786

Structure of 104892-41-3

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General Information

  • CAS No. 104892-41-3
  • Cat. No. CS-0116786
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₄N₂O₂S
  • Molecular Weight 238.31
  • Synonym(s) Ethyl 2-[(anilinocarbothioyl)amino]acetate
  • SMILES O=C(OCC)CNC(NC1=CC=CC=C1)=S

Synthesis

  • Route1

    References

    • Journal of the American Chemical Society, , vol. 38, p. 1556
  • Route2
    • null|null
      103-72-0
    • H-Gly-Oet|CS-0636597
      459-73-4
    • ~70%
    • Ethyl [(anilinocarbonothioyl)amino]acetate|CS-0116786
      104892-41-3

    References

    • Kavalek, Jaromir; Machacek, Vladimir; Svobodova, Gabriela; Sterba, Vojeslav Collection of Czechoslovak Chemical Communications, 1986 , vol. 51, # 2 p. 375 - 390
  • Route3

    References

    • US2575373 , ; US2691652 , ;

Safety Information

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GHS Pictogram : N/A
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Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   50.36
  • LogP   1.5361
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   4

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