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CS-W001157 4
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Methyl 4-(5-(4-(pentyloxy)phenyl)isoxazol-3-yl)benzoate

  • CAS No. 179162-64-2

  • Cat. No. CS-0152126
  • Molecule weight365.42
  • Purity95+%
  • MDL No.MFCD17014817

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

Methyl 4-(5-(4-(pentyloxy)phenyl)isoxazol-3-yl)benzoate|CS-0152126

Structure of 179162-64-2

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General Information

  • CAS No. 179162-64-2
  • Cat. No. CS-0152126
  • Purity 95+%
  • MDL No. MFCD17014817
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₂₂H₂₃NO₄
  • Molecular Weight 365.42
  • Synonym(s) Micafungin Side Chain Methyl Ester
  • SMILES CCCCCOC1=CC=C(C=C1)C2=CC(=NO2)C3=CC=C(C=C3)C(=O)OC

Synthesis

  • Route1

    References

    • Bioorganic and Medicinal Chemistry Letters, , vol. 23, # 11 p. 3253 - 3256
  • Route2
    • 4-Hydroxyacetophenone Paracetamol Impurity|CS-0229792
      99-93-4
    • ~%
    • Methyl 4-(5-(4-(pentyloxy)phenyl)isoxazol-3-yl)benzoate|CS-0152126
      179162-64-2

    References

    • Organic Process Research and Development, , vol. 9, # 2 p. 179 - 184
  • Route3
    • null|null
      110-53-2
    • ~%
    • Methyl 4-(5-(4-(pentyloxy)phenyl)isoxazol-3-yl)benzoate|CS-0152126
      179162-64-2

    References

    • Organic Process Research and Development, , vol. 9, # 2 p. 179 - 184

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   61.56
  • LogP   5.3642
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   8

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