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CS-W001157 4
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2-((3-Methylbut-2-en-1-yl)oxy)naphthalene-1,4-dione

  • CAS No. 42164-69-2

  • Cat. No. CS-0571799
  • Purity≥98%
  • MDL No.None

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

2-((3-Methylbut-2-en-1-yl)oxy)naphthalene-1,4-dione|CS-0571799

Structure of 42164-69-2

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General Information

  • CAS No. 42164-69-2
  • Cat. No. CS-0571799
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₁₄O₃
  • Molecular Weight 242.27
  • Synonym(s) 2-[(3-Methylbut-2-en-1-yl)oxy]naphthalene-1,4-dione
  • SMILES CC(=CCOC1=CC(=O)C2=CC=CC=C2C1=O)C

Synthesis

  • Route1

    References

    • Sun, Jerry S.; Geiser, Andrew H.; Frydman, Benjamin Tetrahedron Letters, 1998 , vol. 39, # 45 p. 8221 - 8224
  • Route2

    References

    • Epifano, Francesco; Genovese, Salvatore; James Squires; Gray, Matthew A. Bioorganic and Medicinal Chemistry Letters, 2012 , vol. 22, # 9 p. 3130 - 3135
  • Route3

    References

    • BTG International Limited Patent: US5962002 A1, 1999 ;

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-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   43.37
  • LogP   2.9323
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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