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CS-W001157 4
Total: USD 88.00

(3-Ethynylphenyl)(methyl)sulfane

  • CAS No. 210905-75-2

  • Cat. No. CS-0038712
  • Purity≥97%
  • MDL No.None

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

(3-Ethynylphenyl)(methyl)sulfane|CS-0038712

Structure of 210905-75-2

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General Information

  • CAS No. 210905-75-2
  • Cat. No. CS-0038712
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈S
  • Molecular Weight 148.23
  • Synonym(s) Benzene, 1-ethynyl-3-(methylthio)- (9CI)
  • SMILES C#CC1=CC(=CC=C1)SC

Synthesis

  • Route1
    • null|null
      124153-80-6
    • ~78%
    • In-stock
      (3-Ethynylphenyl)(methyl)sulfane|CS-0038712
      210905-75-2

    References

    • Chowdhury, Morshed Alam; Dong, Ying; Chen, Qiao-Hong; Abdellatif, Khaled R.A.; Knaus, Edward E. Bioorganic and Medicinal Chemistry, 2008 , vol. 16, # 4 p. 1948 - 1956
  • Route2

    References

    • Mongin, Olivier; Papamicael, Cyril; Hoyler, Nicolas; Gossauer, Albert Journal of Organic Chemistry, 1998 , vol. 63, # 16 p. 5568 - 5580
  • Route3

    References

    • Mongin, Olivier; Papamicael, Cyril; Hoyler, Nicolas; Gossauer, Albert Journal of Organic Chemistry, 1998 , vol. 63, # 16 p. 5568 - 5580

Safety Information

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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   0
  • LogP   2.3898
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   1

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