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CS-W001157 4
Total: USD 88.00

4-(Tert-butyl)phthalic acid

  • CAS No. 14236-13-6

  • Cat. No. CS-0180869
  • Purity≥95%
  • MDL No.None

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

4-(Tert-butyl)phthalic acid|CS-0180869

Structure of 14236-13-6

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General Information

  • CAS No. 14236-13-6
  • Cat. No. CS-0180869
  • Purity ≥95%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₄O₄
  • Molecular Weight 222.24
  • Synonym(s) 4-tert-Butylphthalic acid
  • SMILES O=C(C1=CC=C(C(C)(C)C)C=C1C(O)=O)O

Synthesis

  • Route1
    • 4-tert-Butyl-o-xylene|CS-0153006
      7397-06-0
    • ~84%
    • In-stock
      4-(Tert-butyl)phthalic acid|CS-0180869
      14236-13-6

    References

    • Hanack, Michael; Metz, Josef; Pawlowski, Georg Chemische Berichte, 1982 , vol. 115, # 8 p. 2836 - 2853
  • Route2

    References

    • Hiraiwa, Yukiko; Morinaka, Akihiro; Fukushima, Takayoshi; Kudo, Toshiaki Bioorganic and Medicinal Chemistry Letters, 2009 , vol. 19, # 17 p. 5162 - 5165
  • Route3
    • null|null
      31592-22-0
    • ~%
    • In-stock
      4-(Tert-butyl)phthalic acid|CS-0180869
      14236-13-6

    References

    • Crawford; Glesmann Journal of the American Chemical Society, 1954 , vol. 76, p. 1108

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   74.6
  • LogP   2.3805
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   2

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