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CS-W001157 4
Total: USD 88.00

But-2-yn-1-yl 4-methylbenzenesulfonate

  • CAS No. 56563-37-2

  • Cat. No. CS-0453651
  • Purity≥98%
  • MDL No.None

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

But-2-yn-1-yl 4-methylbenzenesulfonate|CS-0453651

Structure of 56563-37-2

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General Information

  • CAS No. 56563-37-2
  • Cat. No. CS-0453651
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₂O₃S
  • Molecular Weight 224.28
  • Synonym(s) p-Toluenesulfonic Acid 2-Butynyl Ester
  • SMILES CC#CCOS(=O)(=O)C1=CC=C(C)C=C1

Synthesis

  • Route1
    • In-stock
      1-Hydroxybut-2-yne|CS-B1382
      764-01-2
    • null|null
      98-59-9
    • ~95%
    • In-stock
      But-2-yn-1-yl 4-methylbenzenesulfonate|CS-0453651
      56563-37-2

    References

    • Fang, Fang; Vogel, Megan; Hines, Jennifer V.; Bergmeier, Stephen C. Organic and Biomolecular Chemistry, 2012 , vol. 10, # 15 p. 3080 - 3091
  • Route2
    • In-stock
      1-Hydroxybut-2-yne|CS-B1382
      764-01-2
    • null|null
      104-15-4
    • ~88%
    • In-stock
      But-2-yn-1-yl 4-methylbenzenesulfonate|CS-0453651
      56563-37-2

    References

    • Reimann; Friesinger Archiv der Pharmazie, 1985 , vol. 318, # 10 p. 871 - 878
  • Route3

    References

    • Organic Letters, , vol. 4, # 20 p. 3497 - 3500

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   43.37
  • LogP   1.72362
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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