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CS-W001157 4
Total: USD 88.00

1-(Thiophen-2-yl)butane-1,3-dione

  • CAS No. 3051-27-2

  • Cat. No. CS-0450791
  • Purity≥98%
  • MDL No.None

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

1-(Thiophen-2-yl)butane-1,3-dione|CS-0450791

Structure of 3051-27-2

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General Information

  • CAS No. 3051-27-2
  • Cat. No. CS-0450791
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₈O₂S
  • Molecular Weight 168.21
  • Synonym(s) 1,3-Butanedione, 1-(2-thienyl)-
  • SMILES CC(=O)CC(=O)C1=CC=CS1

Synthesis

  • Route1

    References

    • THE UNITED STATES OF AMERICA, as represented by THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES; ILLINOIS STATE UNIVERSITY; THOMAS, Craig, J.; MALONEY, David, J.; BANTUKALLU, Ganesha, Rai; SAYED, Ahmed, A.; SIMEONOV, Anton; WILLIAMS, David, L. Patent: WO2010/19772 A2, 2010 ; Location in patent: Page/Page column 23 ;
  • Route2

    References

    • Elmorsy, Saad S.; Badawy, Doria S.; Khatab, Tamer K. Phosphorus, Sulfur and Silicon and the Related Elements, 2005 , vol. 180, # 1 p. 109 - 116
  • Route3
    • In-stock
      2-Iodothiophene|CS-W007589
      3437-95-4
    • null|null
      201230-82-2
    • null|null
      67-64-1
    • ~56%
    • 1-(Thiophen-2-yl)butane-1,3-dione|CS-0450791
      3051-27-2

    References

    • Schranck, Johannes; Tlili, Anis; Alsabeh, Pamela G.; Neumann, Helfried; Stradiotto, Mark; Beller, Matthias Chemistry - A European Journal, 2013 , vol. 19, # 38 p. 12624 - 12628

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-H319
Precautionary Statements : P264-P270-P280-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   34.14
  • LogP   1.9099
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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