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CS-W001157 4
Total: USD 88.00

4-(Thiophen-2-yl)butan-2-one

  • CAS No. 59594-93-3

  • Cat. No. CS-0511822
  • Molecule weight154.23
  • Purity≥98%
  • MDL No.None

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

4-(Thiophen-2-yl)butan-2-one|CS-0511822

Structure of 59594-93-3

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General Information

  • CAS No. 59594-93-3
  • Cat. No. CS-0511822
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₀OS
  • Molecular Weight 154.23
  • Synonym(s) 4-(2-Thienyl)-2-butanone
  • SMILES CC(CCC1=CC=CS1)=O

Synthesis

  • Route1
    • 4-(Thiophen-2-yl)but-3-en-2-one|CS-0182830
      874-83-9
    • ~80%
    • 4-(Thiophen-2-yl)butan-2-one|CS-0511822
      59594-93-3

    References

    • Nishiyama, Yutaka; Yoshida, Masanori; Ohkawa, Shigeo; Hamanaka, Sawako Journal of Organic Chemistry, 1991 , vol. 56, # 23 p. 6720 - 6722
  • Route2
    • null|null
      1146016-48-9
    • null|null
      78-94-4
    • ~94%
    • 4-(Thiophen-2-yl)butan-2-one|CS-0511822
      59594-93-3

    References

    • Kakusawa, Naoki; Yasuike, Shuji; Kurita, Jyoji Heterocycles, 2009 , vol. 77, # 2 p. 1269 - 1283
  • Route3
    • null|null
      96-43-5
    • null|null
      78-94-4
    • ~31%
    • 4-(Thiophen-2-yl)butan-2-one|CS-0511822
      59594-93-3

    References

    • Condon, Sylvie; Dupre, Daniel; Lachaise, Isabelle; Nedelec, Jean-Yves Synthesis, 2002 , # 12 p. 1752 - 1758

Safety Information

Download SDS
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   17.07
  • LogP   2.2697
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   3

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