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CS-W001157 4
Total: USD 88.00

2,4,6-Trimethylphenol

  • CAS No. 527-60-6

  • Cat. No. CS-0096301
  • Purity≥98%
  • MDL No.MFCD00002235

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

2,4,6-Trimethylphenol|CS-0096301

Structure of 527-60-6

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General Information

  • CAS No. 527-60-6
  • Cat. No. CS-0096301
  • Purity ≥98%
  • MDL No. MFCD00002235
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₂O
  • Molecular Weight None
  • Synonym(s) None
  • SMILES OC1=C(C)C=C(C)C=C1C

Description

2,4,6-Trimethylphenol features a highly sterically hindered aromatic ring stabilized by three methyl groups, conferring exceptional bench stability and resistance to oxidation. This electron-rich phenolic scaffold integrates readily into functional materials and serves as a robust building block in synthetic organic chemistry.

Application

2,4,6-Trimethylphenol serves as a stable, bench-friendly phenolic building block with enhanced steric shielding from its three methyl groups. It functions reliably in electrophilic substitution reactions and acts as a key precursor in the synthesis of specialty polymers and agrochemical intermediates. Its resistance to oxidation and ease of purification support consistent performance in multi-step syntheses.

Synthesis

  • Route1

    References

    • Cammidge, Andrew N.; Goddard, Victoria H. M.; Schubert, Christopher P. J.; Gopee, Hemant; Hughes, David L.; Gonzalez-Lucas, Daniel Organic Letters, 2011 , vol. 13, # 22 p. 6034 - 6037
  • Route2

    References

    • Sergeev, Alexey G.; Schulz, Thomas; Torborg, Christian; Spannenberg, Anke; Neumann, Helfried; Beller, Matthias Angewandte Chemie, International Edition, 2009 , vol. 48, # 41 p. 7595 - 7599
  • Route3
    • null|null
      5450-46-4
    • ~81%
    • In-stock
      2,4,6-Trimethylphenol|CS-0096301
      527-60-6

    References

    • Tsukamoto, Hirokazu; Suzuki, Takamichi; Kondo, Yoshinori Synlett, 2003 , # 8 p. 1105 - 1108

Safety Information

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GHS Pictogram :
GHS No : GHS05,GHS07,GHS08,GHS09
Signal Word : Danger
UN#: 3077
Class : 9
Packing Group : Ⅲ
Hazard Statements : H315-H318-H335-H373-H411
Precautionary Statements : P260-P261-P264-P271-P273-P280-P302+P352-P304+P340-P362+P364-P391-P405-P501

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Computational Chemistry Data

  • TPSA   20.23
  • LogP   2.31746
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   0

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