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CS-W001157 4
Total: USD 88.00

1-(Thiophen-2-yl)pentane-1,4-dione

  • CAS No. 59086-28-1

  • Cat. No. CS-0357987
  • Molecule weight182.24
  • Purity≥98%
  • MDL No.None

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

1-(Thiophen-2-yl)pentane-1,4-dione|CS-0357987

Structure of 59086-28-1

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General Information

  • CAS No. 59086-28-1
  • Cat. No. CS-0357987
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₀O₂S
  • Molecular Weight 182.24
  • Synonym(s) 1,4-Pentanedione, 1-(2-thienyl)-
  • SMILES CC(CCC(C1=CC=CS1)=O)=O

Synthesis

  • Route1
    • 1-(Thiophen-2-yl)butane-1,3-dione|CS-0450791
      3051-27-2
    • null|null
      75-11-6
    • ~60%
    • 1-(Thiophen-2-yl)pentane-1,4-dione|CS-0357987
      59086-28-1

    References

    • Xue, Song; Li, Le-Zhen; Liu, Yong-Kang; Guo, Qing-Xiang Journal of Organic Chemistry, 2006 , vol. 71, # 1 p. 215 - 218
  • Route2

    References

    • Orsini, Monica; Chiarotto, Isabella; Sotgiu, Giovanni; Inesi, Achille Electrochimica Acta, 2010 , vol. 55, # 10 p. 3511 - 3517
  • Route3

    References

    • Pridmore, Simon J.; Slatford, Paul A.; Williams, Jonathan M.J. Tetrahedron Letters, 2007 , vol. 48, # 29 p. 5111 - 5114

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   34.14
  • LogP   2.3
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   4

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