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CS-W001157 4
Total: USD 88.00

4-(4-Fluorobenzamido)benzoic acid

  • CAS No. 54057-46-4

  • Cat. No. CS-0304598
  • Purity≥98%
  • MDL No.None

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

4-(4-Fluorobenzamido)benzoic acid|CS-0304598

Structure of 54057-46-4

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General Information

  • CAS No. 54057-46-4
  • Cat. No. CS-0304598
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₁₀FNO₃
  • Molecular Weight 259.23
  • Synonym(s) 4-[(4-Fluorobenzoyl)amino]benzoic acid
  • SMILES FC1=CC=C(C(NC2=CC=C(C(O)=O)C=C2)=O)C=C1

Synthesis

  • Route1
    • null|null
      172950-63-9
    • ~96%
    • 4-(4-Fluorobenzamido)benzoic acid|CS-0304598
      54057-46-4

    References

    • Sattigeri, Jitendra A.; Andappan, Murugaiah M.S.; Kishore, Kaushal; Sethi, Sachin; Kandalkar, Sachin Ramesh; Pal, Chanchal Kumar; Mahajan, Dipak C.; Ahmed, Shahadat; Parkale, Santhosh Sadashiv; Srinivasan, T.; Sharma, Lalima; Bansal, Vinay S.; Chugh, Anita; Davis, Joseph Alexanand Patent: US2008/300251 A1, 2008 ; Location in patent: Page/Page column 16 ;
  • Route2

    References

    • Zheng, Can-Hui; Yang, Hui; Zhang, Meng; Lu, Shi-Hai; Shi, Duo; Wang, Juan; Chen, Xiu-Hua; Ren, Xiao-Hui; Liu, Jia; Lv, Jia-Guo; Zhu, Ju; Zhou, You-Jun Bioorganic and Medicinal Chemistry Letters, 2012 , vol. 22, # 1 p. 39 - 44
  • Route3

    References

    • Zheng, Can-Hui; Yang, Hui; Zhang, Meng; Lu, Shi-Hai; Shi, Duo; Wang, Juan; Chen, Xiu-Hua; Ren, Xiao-Hui; Liu, Jia; Lv, Jia-Guo; Zhu, Ju; Zhou, You-Jun Bioorganic and Medicinal Chemistry Letters, 2012 , vol. 22, # 1 p. 39 - 44

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   66.4
  • LogP   2.7762
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   3

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