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CS-W001157 4
Total: USD 88.00

4-(Phenylmethyl)-1,2,3-benzenetriol

  • CAS No. 17345-66-3

  • Cat. No. CS-0207661
  • Molecule weight216.23
  • Purity≥98%
  • MDL No.MFCD08276435

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

4-(Phenylmethyl)-1,2,3-benzenetriol|CS-0207661

Structure of 17345-66-3

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General Information

  • CAS No. 17345-66-3
  • Cat. No. CS-0207661
  • Purity ≥98%
  • MDL No. MFCD08276435
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₂O₃
  • Molecular Weight 216.23
  • Synonym(s) ethyl 4-oxo-2-(trifluoroacetyl)pentanoate
  • SMILES C1=CC=C(C=C1)CC2=C(C(=C(C=C2)O)O)O

Synthesis

  • Route1
    • null|null
      100-44-7
    • In-stock
      Pyrogallol|CS-W019928
      87-66-1
    • ~73%
    • In-stock
      4-(Phenylmethyl)-1,2,3-benzenetriol|CS-0207661
      17345-66-3

    References

    • Kumar, Jaladi Ashok; Tiwari, Ashok Kumar; Saidachary, Gannerla; Kumar, Domati Anand; Ali, Zehra; Sridhar, Balasubramanian; Raju, Bhimapaka China Medicinal Chemistry, 2013 , vol. 9, # 6 p. 806 - 811
  • Route2

    References

    • Buu-Hoi Journal of Organic Chemistry, 1953 , vol. 18, p. 1723,1727

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
Precautionary Statements : P264-P280-P302+P352-P362+P364

Quality Control

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Computational Chemistry Data

  • TPSA   60.69
  • LogP   2.3942
  • H_Acceptors   3
  • H_Donors   3
  • Rotatable_Bonds   2

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