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CS-W001157 4
Total: USD 88.00

(3S,4S)-3-Hexyl-4-((S)-2-hydroxytridecyl)oxetan-2-one

  • CAS No. 68711-40-0

  • Cat. No. CS-0141153
  • Purity≥98%
  • MDL No.MFCD09833093

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

(3S,4S)-3-Hexyl-4-((S)-2-hydroxytridecyl)oxetan-2-one|CS-0141153

Structure of 68711-40-0

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General Information

  • CAS No. 68711-40-0
  • Cat. No. CS-0141153
  • Purity ≥98%
  • MDL No. MFCD09833093
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₂₂H₄₂O₃
  • Molecular Weight 354.57
  • Synonym(s) OrlistatImpurity24/(3S,4S)-3-Hexyl-4-((S)-2-hydroxytridecyl)oxetan-2-one
  • SMILES O=C1O[C@@H](C[C@@H](O)CCCCCCCCCCC)[C@@H]1CCCCCC

Synthesis

  • Route1
    • null|null
      114264-05-0
    • ~89%
    • (3S,4S)-3-Hexyl-4-((S)-2-hydroxytridecyl)oxetan-2-one|CS-0141153
      68711-40-0

    References

    • Yadav; Reddy, M. Sridhar; Prasad Tetrahedron Letters, 2006 , vol. 47, # 29 p. 4995 - 4998
  • Route2
    • null|null
      1197399-35-1
    • ~36%
    • (3S,4S)-3-Hexyl-4-((S)-2-hydroxytridecyl)oxetan-2-one|CS-0141153
      68711-40-0

    References

    • Chongqing Zhien Pharmaceutical Co., Ltd.; Sichuan University Patent: EP2280007 A1, 2011 ; Location in patent: Page/Page column 11-12 ;
  • Route3
    • null|null
      296242-39-2
    • ~94%
    • (3S,4S)-3-Hexyl-4-((S)-2-hydroxytridecyl)oxetan-2-one|CS-0141153
      68711-40-0

    References

    • Venukadasula, Phanindra K. M.; Chegondi, Rambabu; Maitra, Soma; Hanson, Paul R. Organic Letters, 2010 , vol. 12, # 7 p. 1556 - 1559

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   46.53
  • LogP   6.1703
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   17

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