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CS-W001157 4
Total: USD 88.00

(2-Amino-4,5-dimethylthiophen-3-yl)(phenyl)methanone

  • CAS No. 42024-93-1

  • Cat. No. CS-0313192
  • Molecule weight231.31
  • Purity≥96%
  • MDL No.None

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

(2-Amino-4,5-dimethylthiophen-3-yl)(phenyl)methanone|CS-0313192

Structure of 42024-93-1

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General Information

  • CAS No. 42024-93-1
  • Cat. No. CS-0313192
  • Purity ≥96%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₃NOS
  • Molecular Weight 231.31
  • Synonym(s) 2-AMINO-3-BENZOYL-4,5-DIMETHYLTHIOPHENE
  • SMILES CC1=C(C)SC(=C1C(=O)C2=CC=CC=C2)N

Synthesis

  • Route1

    References

    • F.HOFFMANN-LA ROCHE AG Patent: WO2006/63732 A1, 2006 ; Location in patent: Page/Page column 30 ;
  • Route2
    • null|null
      399043-17-5
    • ~95%
    • (2-Amino-4,5-dimethylthiophen-3-yl)(phenyl)methanone|CS-0313192
      42024-93-1

    References

    • Tranberg, C. Elisabet; Zickgraf, Andrea; Giunta, Brian N.; Luetjens, Henning; Figler, Heidi; Murphree, Lauren J.; Falke, Ruediger; Fleischer, Holger; Linden, Joel; Scammells, Peter J.; Olsson, Ray A. Journal of Medicinal Chemistry, 2002 , vol. 45, # 2 p. 382 - 389
  • Route3
    • null|null
      110-91-8
    • In-stock
      3-Oxo-3-phenylpropanenitrile|CS-W004658
      614-16-4
    • null|null
      565-80-0
    • ~%
    • (2-Amino-4,5-dimethylthiophen-3-yl)(phenyl)methanone|CS-0313192
      42024-93-1

    References

    • Medco Research, Inc Patent: US6323214 B1, 2001 ;

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-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   43.09
  • LogP   3.17814
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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