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CS-W001157 4
Total: USD 88.00

(S)-(1,4-Dioxan-2-yl)methyl 4-methylbenzenesulfonate

  • CAS No. 917882-64-5

  • Cat. No. CS-0158105
  • Purity≥95%
  • MDL No.None

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

(S)-(1,4-Dioxan-2-yl)methyl 4-methylbenzenesulfonate|CS-0158105

Structure of 917882-64-5

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General Information

  • CAS No. 917882-64-5
  • Cat. No. CS-0158105
  • Purity ≥95%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₆O₅S
  • Molecular Weight 272.32
  • Synonym(s) [(2S)-1,4-dioxan-2-yl]methyl 4-methylbenzenesulfonate
  • SMILES C=1(C=CC(=CC1)C)S(=O)(=O)OC[C@H]2OCCOC2

Synthesis

  • Route1
    • null|null
      98-59-9
    • ~%
    • (S)-(1,4-Dioxan-2-yl)methyl 4-methylbenzenesulfonate|CS-0158105
      917882-64-5

    References

    • Dinsmore, Christopher J.; Gabarda Ortega, Ana Esther; Guerin, David J.; Jewell, James P.; Katz, Jason D.; Lim, Jongwon; Machacek, Michelle R.; Otte, Ryan D.; Young, Jonathan R. Patent: US2006/293358 A1, 2006 ; Location in patent: Page/Page column 51 ; US 20060293358 A1
  • Route2
    • null|null
      1170702-79-0
    • null|null
      98-59-9
    • ~%
    • (S)-(1,4-Dioxan-2-yl)methyl 4-methylbenzenesulfonate|CS-0158105
      917882-64-5

    References

    • Avalle, Paolo; Foley, Jennifer R.; Mullens, Peter; Wang, Yaling; Yehl, Peter Patent: US2009/182002 A1, 2009 ; Location in patent: Page/Page column 16 ; US 20090182002 A1
  • Route3
    • null|null
      861852-08-6
    • ~%
    • (S)-(1,4-Dioxan-2-yl)methyl 4-methylbenzenesulfonate|CS-0158105
      917882-64-5

    References

    • Stewart, Gavin W.; Brands, Karel M. J.; Brewer, Sarah E.; Cowden, Cameron J.; Davies, Antony J.; Edwards, John S.; Gibson, Andrew W.; Hamilton, Simon E.; Katz, Jason D.; Keen, Stephen P.; Mullens, Peter R.; Scott, Jeremy P.; Wallace, Debra J.; Wise, Christopher S. Organic Process Research and Development, 2010 , vol. 14, # 4 p. 849 - 858

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   61.83
  • LogP   1.11572
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   4

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