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CS-W001157 4
Total: USD 88.00

4-(4-Nitrophenoxy)benzoic acid

  • CAS No. 16309-45-8

  • Cat. No. CS-0198970
  • Purity≥98%
  • MDL No.None

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

4-(4-Nitrophenoxy)benzoic acid|CS-0198970

Structure of 16309-45-8

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General Information

  • CAS No. 16309-45-8
  • Cat. No. CS-0198970
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₉NO₅
  • Molecular Weight 259.21
  • Synonym(s) None
  • SMILES C1=C(C=CC(=C1)OC2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

Synthesis

  • Route1
    • 1-Methyl-4-(4-nitrophenoxy)benzene|CS-0663100
      3402-74-2
    • ~95%
    • 4-(4-Nitrophenoxy)benzoic acid|CS-0198970
      16309-45-8

    References

    • Xia, Lianlian; Zhai, Xuejiao; Xiong, Xuhai; Chen, Ping RSC Advances, 2014 , vol. 4, # 9 p. 4646 - 4655
  • Route2
    • null|null
      100-00-5
    • 4-Hydroxybenzoic acid  Cetirizine Impurity|CS-0167040
      99-96-7
    • ~%
    • 4-(4-Nitrophenoxy)benzoic acid|CS-0198970
      16309-45-8

    References

    • US6518267 B1, ; US 6518267 B1
  • Route3

    References

    • Journal of the American Chemical Society, , vol. 55, p. 1289

Safety Information

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

Quality Control

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Computational Chemistry Data

  • TPSA   89.67
  • LogP   3.0853
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   4

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