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CS-W001157 4
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1-(2-(Benzyloxy)-6-hydroxyphenyl)ethan-1-one

  • CAS No. 4047-24-9

  • Cat. No. CS-0357596
  • Molecule weight242.27
  • Purity95+%
  • MDL No.None

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

1-(2-(Benzyloxy)-6-hydroxyphenyl)ethan-1-one|CS-0357596

Structure of 4047-24-9

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General Information

  • CAS No. 4047-24-9
  • Cat. No. CS-0357596
  • Purity 95+%
  • 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) 1-[2-(Benzyloxy)-6-hydroxyphenyl]ethan-1-one
  • SMILES CC(=O)C1=C(C=CC=C1OCC2=CC=CC=C2)O

Synthesis

  • Route1

    References

    • Smith, Jeffrey A.; Maloney, David J.; Hecht, Sidney M.; Lannigan, Deborah A. Bioorganic and Medicinal Chemistry, 2007 , vol. 15, # 14 p. 5018 - 5034
  • Route2

    References

    • Zhao, Xiaolong; Liu, Jie; Xie, Zhixiang; Li, Ying Synthesis (Germany), 2012 , vol. 44, # 14 art. no. SS-2012-H0237-OP, p. 2217 - 2224
  • Route3

    References

    • Brunskole, Mojca; Stefane, Bogdan; Zorko, Karmen; Anderluh, Marko; Stojan, Jure; Lanisnik Rizner, Tea; Gobec, Stanislav Bioorganic and Medicinal Chemistry, 2008 , vol. 16, # 11 p. 5881 - 5889

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   46.53
  • LogP   3.1738
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   4

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