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Methyl 2-(4-(1-hydroxy-4-(4-(hydroxydiphenylmethyl)piperidin-1-yl)butyl)phenyl)-2-methylpropanoate

  • CAS No. 154825-96-4

  • Cat. No. CS-0154633
  • Molecule weight515.68
  • Purity≥97%
  • MDL No.MFCD08063763

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

Methyl 2-(4-(1-hydroxy-4-(4-(hydroxydiphenylmethyl)piperidin-1-yl)butyl)phenyl)-2-methylpropanoate|CS-0154633

Structure of 154825-96-4

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General Information

  • CAS No. 154825-96-4
  • Cat. No. CS-0154633
  • Purity ≥97%
  • MDL No. MFCD08063763
  • Storage RT, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₃₃H₄₁NO₄
  • Molecular Weight 515.68
  • Synonym(s) Fexofenadine Methyl Ester
  • SMILES CC(C)(C1=CC=C(C=C1)C(CCCN2CCC(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O)O)C(=O)OC

Synthesis

  • Route1

    References

    • Kawai, Stephen H.; Hambalek, Robert J.; Just, George Journal of Organic Chemistry, 1994 , vol. 59, # 9 p. 2620 - 2622
  • Route2
    • null|null
      43076-23-9
    • null|null
      31469-15-5
    • ~21%
    • Methyl 2-(4-(1-hydroxy-4-(4-(hydroxydiphenylmethyl)piperidin-1-yl)butyl)phenyl)-2-methylpropanoate|CS-0154633
      154825-96-4

    References

    • AMR Technology, Inc. Patent: US2006/63808 A1, 2006 ; Location in patent: Page/Page column 8; 10; 12; 14 ;
  • Route3

    References

    • US2012/309973 A1, ; 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-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   70
  • LogP   5.5989
  • H_Acceptors   5
  • H_Donors   2
  • Rotatable_Bonds   10

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