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CS-W001157 4
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1-(4-Methyl-2-(phenylamino)thiazol-5-yl)ethan-1-one

  • CAS No. 31609-42-4

  • Cat. No. CS-0313581
  • Molecule weight232.30
  • Purity≥98%
  • MDL No.None

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

1-(4-Methyl-2-(phenylamino)thiazol-5-yl)ethan-1-one|CS-0313581

Structure of 31609-42-4

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General Information

  • CAS No. 31609-42-4
  • Cat. No. CS-0313581
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₂N₂OS
  • Molecular Weight 232.30
  • Synonym(s) 2-Phenylamino-4-Methyl-5-Acetyl Thiazole
  • SMILES CC1=C(C(=O)C)SC(=N1)NC2=CC=CC=C2

Synthesis

  • Route1

    References

    • Smith, Breland; Chang, Hui-Hua; Medda, Federico; Gokhale, Vijay; Dietrich, Justin; Davis, Angela; Meuillet, Emmanuelle J.; Hulme, Christopher Bioorganic and Medicinal Chemistry Letters, 2012 , vol. 22, # 10 p. 3567 - 3570
  • Route2

    References

    • Dahiya, Rajinder; Pujari, H. K. Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1986 , vol. 25, p. 966
  • Route3

    References

    • Shi, Hai-Bo; Zhang, Shi-Jie; Ge, Qiu-Fu; Guo, Dian-Wu; Cai, Chao-Ming; Hu, Wei-Xiao Bioorganic and Medicinal Chemistry Letters, 2010 , vol. 20, # 22 p. 6555 - 6559

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-H312-H332
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P363-P501

Quality Control

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Computational Chemistry Data

  • TPSA   41.99
  • LogP   3.39772
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   3

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