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CS-W001157 4
Total: USD 88.00

4-Formylbenzoic acid

  • CAS No. 619-66-9

  • Cat. No. CS-W018162
  • Purity≥96%
  • MDL No.MFCD00006951

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

4-Formylbenzoic acid|CS-W018162

Structure of 619-66-9

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General Information

  • CAS No. 619-66-9
  • Cat. No. CS-W018162
  • Purity ≥96%
  • MDL No. MFCD00006951
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₆O₃
  • Molecular Weight 150.13
  • Synonym(s) Tetraphthalaldehydic acid
  • SMILES C1=C(C=CC(=C1)C=O)C(O)=O

Description

4-Formylbenzoic acid is an important intermediate in the synthesis of terepthalic acid. It reacts with barium carbonate to yield two-dimensional barium(II) coordination polymer.4-Formylbenzoic acid has been used as reagent during esterification of 2,2,6,6-tetramethyl-4-oxopiperidinyl-1-oxyl to yield 4-hydroxy-2,2,6,6-tetramethylpiperidine-1-oxyl 4-formylbenzoate.

Synthesis

  • Route1

    References

    • Gu, Liuqun; Zhang, Yugen Journal of the American Chemical Society, 2010 , vol. 132, # 3 p. 914 - 915
  • Route2
    • null|null
      106-42-3
    • ~1%
    • In-stock
      Terephthalic acid|CS-W010814
      100-21-0
    • In-stock
      4-Formylbenzoic acid|CS-W018162
      619-66-9

    References

    • WO2005/779 A2, ; Page 13-14 ;
  • Route3

    References

    • University of Kansas Patent: US2008/139841 A1, 2008 ; Location in patent: Page/Page column 4 ;

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   54.37
  • LogP   1.1973
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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