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CS-W001157 4
Total: USD 88.00
  • CAS No. 6093-71-6

  • Cat. No. CS-0033018
  • Purity≥98%
  • MDL No.MFCD00017641

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

YZ9|CS-0033018

Structure of 6093-71-6

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General Information

  • CAS No. 6093-71-6
  • Cat. No. CS-0033018
  • Purity ≥98%
  • MDL No. MFCD00017641
  • Storage -20°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₀O₅
  • Molecular Weight 234.21
  • Synonym(s) None
  • SMILES O=C1OC2=CC(O)=CC=C2C=C1C(OCC)=O

Description

YZ9 is a bench-stable, moisture-tolerant reagent designed for efficient coupling reactions in synthetic organic chemistry. Featuring a robust heterocyclic core, it enables rapid functionalization under mild conditions. This reagent streamlines access to complex molecular architectures with high chemoselectivity and minimal purification overhead.

Application

YZ9 serves as a robust scaffold for constructing diverse heterocyclic systems, particularly in the synthesis of biologically relevant nitrogen-containing rings. Its well-defined reactivity profile enables efficient coupling and cyclization reactions under mild conditions, offering excellent functional group tolerance and bench stability. Ideal for medicinal chemistry campaigns requiring scalable, high-yielding transformations, YZ9 facilitates rapid access to core structures found in drug discovery programs.

Synthesis

  • Route1
    • null|null
      105-53-3
    • In-stock
      2,4-Dihydroxybenzaldehyde|CS-W007539
      95-01-2
    • ~97%
    • In-stock
      YZ9|CS-0033018
      6093-71-6

    References

    • Vieira, Lucas C.C.; Paixao, Marcio Weber; Correa, Arlene G. Tetrahedron Letters, 2012 , vol. 53, # 22 p. 2715 - 2718
  • Route2
    • Ethyl 7-acetoxy-2-oxo-2H-chromene-3-carboxylate|CS-0334495
      13209-77-3
    • ~92%
    • In-stock
      YZ9|CS-0033018
      6093-71-6

    References

    • Dawson, Marcia J.; Fontana, Joseph A.; Zhang, Xiao-kun; Leid, Mark; Jong, Ling; Hobbs, Peter D. Patent: US2003/176506 A1, 2003 ;
  • Route3
    • null|null
      105-53-3
    • In-stock
      2,4-Dihydroxybenzaldehyde|CS-W007539
      95-01-2
    • ~%
    • null|null
      1313212-09-7
    • null|null
      1401998-72-8
    • In-stock
      YZ9|CS-0033018
      6093-71-6

    References

    • 3M INNOVATIVE PROPERTIES COMPANY; ROSCOE, Stephen, B.; CHOU, Shih-Hung; MOELLER, Stephanie, J.; MILLER, Jesse, D.; HALVERSON, Kurt, J.; BJORK, Jason, W. Patent: WO2012/134724 A1, 2012 ; Location in patent: Page/Page column 36-38 ;

Safety Information

Download SDS
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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   76.74
  • LogP   1.6753
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   2

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