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CS-W001157 4
Total: USD 88.00

1-(5-Ethoxy-2-hydroxyphenyl)ethan-1-one

  • CAS No. 56414-14-3

  • Cat. No. CS-0550632
  • Purity≥98%
  • MDL No.None

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

1-(5-Ethoxy-2-hydroxyphenyl)ethan-1-one|CS-0550632

Structure of 56414-14-3

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General Information

  • CAS No. 56414-14-3
  • Cat. No. CS-0550632
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₂O₃
  • Molecular Weight 180.20
  • Synonym(s) 5'-Ethoxy-2'-hydroxyacetophenone
  • SMILES O=C(C1=CC(OCC)=CC=C1O)C

Synthesis

  • Route1

    References

    • Journal of Medicinal Chemistry, , vol. 45, # 10 p. 2041 - 2055
  • Route2

    References

    • Roma, Giorgio; Di Braccio, Mario; Carrieri, Antonio; Grossi, Giancarlo; Leoncini, Giuliana; Grazia Signorello, Maria; Carotti, Angelo Bioorganic and Medicinal Chemistry, 2003 , vol. 11, # 1 p. 123 - 138
  • Route3

    References

    • Boyer, Jessica L.; Krum, Jodie E.; Myers, Michael C.; Fazal, Aleem N.; Wigal, Carl T. Journal of Organic Chemistry, 2000 , vol. 65, # 15 p. 4712 - 4714

Safety Information

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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

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Computational Chemistry Data

  • TPSA   46.53
  • LogP   1.9935
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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