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CS-W001157 4
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3-Benzyl-7-hydroxy-4-methyl-2H-chromen-2-one

  • CAS No. 86-44-2

  • Cat. No. CS-0153467
  • Molecule weight266.29
  • Purity≥97%
  • MDL No.None

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

3-Benzyl-7-hydroxy-4-methyl-2H-chromen-2-one|CS-0153467

Structure of 86-44-2

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General Information

  • CAS No. 86-44-2
  • Cat. No. CS-0153467
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₇H₁₄O₃
  • Molecular Weight 266.29
  • Synonym(s) 7-hydroxy-4-methyl-3-(phenylmethyl)chromen-2-one
  • SMILES CC1=C(CC2=CC=CC=C2)C(=O)OC3=C1C=CC(=C3)O

Synthesis

  • Route1

    References

    • Wang, Chao; Zhang, Hao; Xu, Fengrong; Niu, Yan; Wu, Yun; Wang, Xin; Peng, Yihong; Sun, Jing; Liang, Lei; Xu, Ping Molecules, 2013 , vol. 18, # 5 p. 6057 - 6091
  • Route2
    • null|null
      108-46-3
    • null|null
      433733-19-8
    • ~78%
    • 3-Benzyl-7-hydroxy-4-methyl-2H-chromen-2-one|CS-0153467
      86-44-2

    References

    • Kim, Sundae; Kang, Dongjin; Lee, Chang-Hee; Lee, Phil Ho Journal of Organic Chemistry, 2012 , vol. 77, # 15 p. 6530 - 6537
  • Route3
    • null|null
      100-39-0
    • ~%
    • 3-Benzyl-7-hydroxy-4-methyl-2H-chromen-2-one|CS-0153467
      86-44-2

    References

    • Molecules, , vol. 18, # 5 p. 6057 - 6091

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H317-H319
Precautionary Statements : P261-P264-P272-P280-P302+P352-P362+P364-P501

Quality Control

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Computational Chemistry Data

  • TPSA   50.44
  • LogP   3.39782
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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