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CS-W001157 4
Total: USD 88.00

4-(4-(Trifluoromethyl)phenoxy)benzaldehyde

  • CAS No. 90035-20-4

  • Cat. No. CS-0157439
  • Molecule weight266.22
  • Purity≥95%
  • MDL No.None

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

4-(4-(Trifluoromethyl)phenoxy)benzaldehyde|CS-0157439

Structure of 90035-20-4

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General Information

  • CAS No. 90035-20-4
  • Cat. No. CS-0157439
  • Purity ≥95%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₉F₃O₂
  • Molecular Weight 266.22
  • Synonym(s) 4-(4-TRIFLUOROMETHYL-PHENOXY)-BENZALDEHYDE
  • SMILES C1=C(C=CC(=C1)OC2=CC=C(C=C2)C(F)(F)F)C=O

Synthesis

  • Route1
    • 4-(Trifluoromethyl)phenol Fluoxetine  Impurity|CS-0229006
      402-45-9
    • p-Fluorobenzenecarboxaldehyde Atorvastatin calcium|CS-0214005
      459-57-4
    • ~74%
    • 4-(4-(Trifluoromethyl)phenoxy)benzaldehyde|CS-0157439
      90035-20-4

    References

    • SMITHKLINE BEECHAM CORPORATION; BOUILLOT, Anne Marie Jeanne; DODIC, Nerina; GELLIBERT, Francoise Jeanne; MIRGUET, Olivier Patent: WO2010/15652 A2, 2010 ; Location in patent: Page/Page column 52-53 ; WO 2010/015652 A2
  • Route2

    References

    • Chen, Jiuxi; Wang, Xingyong; Zheng, Xingwang; Ding, Jinchang; Liu, Miaochang; Wu, Huayue Tetrahedron, 2012 , vol. 68, # 43 p. 8905 - 8907
  • Route3

    References

    • Zheng, Xingwang; Ding, Jinchang; Chen, Jiuxi; Gao, Wenxiao; Liu, Miaochang; Wu, Huayue Organic Letters, 2011 , vol. 13, # 7 p. 1726 - 1729

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   26.3
  • LogP   4.3102
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   3

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