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1-(2-Hydroxy-5-methylphenyl)-3-phenylpropane-1,3-dione

  • CAS No. 29976-82-7

  • Cat. No. CS-0153322
  • Molecule weight254.28
  • Purity≥97%
  • MDL No.MFCD00209591

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

1-(2-Hydroxy-5-methylphenyl)-3-phenylpropane-1,3-dione|CS-0153322

Structure of 29976-82-7

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General Information

  • CAS No. 29976-82-7
  • Cat. No. CS-0153322
  • Purity ≥97%
  • MDL No. MFCD00209591
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₆H₁₄O₃
  • Molecular Weight 254.28
  • Synonym(s) 1-(2-HYDROXY-5-METHYLPHENYL)-3-PHENYL-1,3-PROPANEDIONE
  • SMILES CC1=CC(=C(C=C1)O)C(=O)CC(=O)C2=CC=CC=C2

Synthesis

  • Route1
    • 2-Acetyl-4-methylphenyl benzoate|CS-0664610
      4010-19-9
    • ~77%
    • 1-(2-Hydroxy-5-methylphenyl)-3-phenylpropane-1,3-dione|CS-0153322
      29976-82-7

    References

    • Mumtazuddin Journal of the Indian Chemical Society, 2006 , vol. 83, # 8 p. 835 - 837
  • Route2

    References

    • Lamba; Kumar, Suresh; Makrandi Journal of Chemical Research, 2006 , # 2 p. 133 - 134
  • Route3
    • null|null
      98-88-4
    • ~%
    • 1-(2-Hydroxy-5-methylphenyl)-3-phenylpropane-1,3-dione|CS-0153322
      29976-82-7

    References

    • Journal of Organic Chemistry, , vol. 56, # 26 p. 7292 - 7297

Safety Information

Download SDS
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

Quality Control

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Computational Chemistry Data

  • TPSA   54.37
  • LogP   3.15632
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   4

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