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CS-W001157 4
Total: USD 88.00

4,5-Bis(benzoylthio)-1,3-dithiole-2-thione

  • CAS No. 68494-08-6

  • Cat. No. CS-0095837
  • Purity≥98%
  • MDL No.MFCD00059894

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

4,5-Bis(benzoylthio)-1,3-dithiole-2-thione|CS-0095837

Structure of 68494-08-6

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General Information

  • CAS No. 68494-08-6
  • Cat. No. CS-0095837
  • Purity ≥98%
  • MDL No. MFCD00059894
  • Storage 4°C, protect from light, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₇H₁₀O₂S₅
  • Molecular Weight 406.59
  • Synonym(s) 4,5-bis-(Benzoylthio)-1,3-dithiole-2-thione
  • SMILES S=C1SC(SC(C2=CC=CC=C2)=O)=C(SC(C3=CC=CC=C3)=O)S1

Synthesis

  • Route1
    • null|null
      98-88-4
    • Bis(tetraethylammonium) bis(2-thioxo-1,3-dithiole-4,5-dithiolato)zincate, 97%|CS-0369836
      72022-68-5
    • ~95%
    • 4,5-Bis(benzoylthio)-1,3-dithiole-2-thione|CS-0095837
      68494-08-6

    References

    • Shao, Min; Dongare, Prateek; Dawe, Louise N.; Thompson, David W.; Zhao, Yuming Organic Letters, 2010 , vol. 12, # 13 p. 3050 - 3053
  • Route2
    • null|null
      98-88-4
    • ~0%
    • 4,5-Bis(methylthio)-1,3-dithiole-2-thione|CS-0303849
      49638-64-4
    • 4,5-Bis(benzoylthio)-1,3-dithiole-2-thione|CS-0095837
      68494-08-6
    • null|null
      161090-91-1

    References

    • Wang, Changsheng; Bryce, Martin R.; Batsanov, Andrei S.; Howard, Judith A. K. Chemistry - A European Journal, 1997 , vol. 3, # 10 p. 1679 - 1690
  • Route3
    • null|null
      74-88-4
    • ~0%
    • 4,5-Bis(methylthio)-1,3-dithiole-2-thione|CS-0303849
      49638-64-4
    • 4,5-Bis(benzoylthio)-1,3-dithiole-2-thione|CS-0095837
      68494-08-6
    • null|null
      161090-91-1

    References

    • Wang, Changsheng; Bryce, Martin R.; Batsanov, Andrei S.; Howard, Judith A. K. Chemistry - A European Journal, 1997 , vol. 3, # 10 p. 1679 - 1690

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   34.14
  • LogP   6.40409
  • H_Acceptors   7
  • H_Donors   0
  • Rotatable_Bonds   4

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