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CS-W001157 4
Total: USD 88.00

(2,4,6-Trimethyl-phenoxy)-acetic acid

  • CAS No. 13333-81-8

  • Cat. No. CS-0307700
  • Molecule weight194.23
  • Purity≥98%
  • MDL No.MFCD00224887

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

(2,4,6-Trimethyl-phenoxy)-acetic acid|CS-0307700

Structure of 13333-81-8

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General Information

  • CAS No. 13333-81-8
  • Cat. No. CS-0307700
  • Purity ≥98%
  • MDL No. MFCD00224887
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₄O₃
  • Molecular Weight 194.23
  • Synonym(s) None
  • SMILES O=C(COC1=C(C)C=C(C)C=C1C)O

Synthesis

  • Route1
    • In-stock
      2,4,6-Trimethylphenol|CS-0096301
      527-60-6
    • null|null
      79-11-8
    • ~70%
    • In-stock
      (2,4,6-Trimethyl-phenoxy)-acetic acid|CS-0307700
      13333-81-8

    References

    • Valenta; Nemec; Protiva Collection of Czechoslovak Chemical Communications, 1983 , vol. 48, # 4 p. 1089 - 1096
  • Route2
    • null|null
      224648-08-2
    • ~%
    • In-stock
      (2,4,6-Trimethyl-phenoxy)-acetic acid|CS-0307700
      13333-81-8

    References

    • Rueda-Becerril, Montserrat; Mahe, Olivier; Drouin, Myriam; Majewski, Marek B.; West, Julian G.; Wolf, Michael O.; Sammis, Glenn M.; Paquin, Jean-Francois Journal of the American Chemical Society, 2014 , vol. 136, # 6 p. 2637 - 2641
  • Route3

    References

    • Sham, Hing L.; Betebenner, David A.; Chen, Xiaoqi; Saldivar, Ayda; Vasavanonda, Sudthida; Kempf, Dale J.; Plattner, Jacob J.; Norbeck, Daniel W. Bioorganic and Medicinal Chemistry Letters, 2002 , vol. 12, # 8 p. 1185 - 1187

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   46.53
  • LogP   2.07526
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   3

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