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CS-W001157 4
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1-Methyl-3-phenyl-2-thioxo-4-imidazolidinone

  • CAS No. 18391-77-0

  • Cat. No. CS-0116953
  • Purity≥98%
  • MDL No.None

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

1-Methyl-3-phenyl-2-thioxo-4-imidazolidinone|CS-0116953

Structure of 18391-77-0

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General Information

  • CAS No. 18391-77-0
  • Cat. No. CS-0116953
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₀N₂OS
  • Molecular Weight 206.26
  • Synonym(s) 1-methyl-3-phenyl-2-thioxo-imidazolidin-4-one
  • SMILES O=C(CN1C)N(C2=CC=CC=C2)C1=S

Synthesis

  • Route1

    References

    • Elokdah, Hassan; Sulkowski, Theodore S.; Abou-Gharbia, Magid; Butera, John A.; Chai, Sie-Yearl; McFarlane, Geraldine R.; McKean, Mar-Lee; Babiak, John L.; Adelman, Steven J.; Quinet, Elaine M. Journal of Medicinal Chemistry, 2004 , vol. 47, # 3 p. 681 - 695
  • Route2

    References

    • Khodair, Ahmed I.; Nielsen, John Heterocycles, 2002 , vol. 57, # 6 p. 1017 - 1032
  • Route3
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      103-72-0
    • ~%
    • 1-Methyl-3-phenyl-2-thioxo-4-imidazolidinone|CS-0116953
      18391-77-0

    References

    • Cook, Cox Journal of the Chemical Society, 1949 , p. 2342,2345

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

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Computational Chemistry Data

  • TPSA   23.55
  • LogP   1.2499
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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