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CS-W001157 4
Total: USD 88.00

Methyl 2-(4-(4-chlorobutanoyl)phenyl)-2-methylpropanoate

  • CAS No. 154477-54-0

  • Cat. No. CS-0337080
  • Molecule weight282.76
  • Purity95+%
  • MDL No.MFCD09031254

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

Methyl 2-(4-(4-chlorobutanoyl)phenyl)-2-methylpropanoate|CS-0337080

Structure of 154477-54-0

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General Information

  • CAS No. 154477-54-0
  • Cat. No. CS-0337080
  • Purity 95+%
  • MDL No. MFCD09031254
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₁₉ClO₃
  • Molecular Weight 282.76
  • Synonym(s) None
  • SMILES CC(C)(C1=CC=C(C=C1)C(=O)CCCCl)C(=O)OC

Synthesis

  • Route1
    • 2-(4-(4-Chlorobutanoyl)phenyl)-2-methylpropanoic acid|CS-0699560
      169280-21-1
    • ~94%
    • Methyl 2-(4-(4-chlorobutanoyl)phenyl)-2-methylpropanoate|CS-0337080
      154477-54-0

    References

    • Merrell Pharmaceuticals Inc. Patent: US6242606 B1, 2001 ;
  • Route2
    • 2-(4-(4-Chlorobutanoyl)phenyl)-2-methylpropanoic acid|CS-0699560
      169280-21-1
    • null|null
      77-78-1
    • ~87%
    • Methyl 2-(4-(4-chlorobutanoyl)phenyl)-2-methylpropanoate|CS-0337080
      154477-54-0

    References

    • Merrell Pharmaceuticals, Inc. Patent: US6348597 B2, 2002 ; Location in patent: Page column 79 ;
  • Route3

    References

    • AMR Technology, Inc. Patent: US2006/63808 A1, 2006 ; Location in patent: Page/Page column 9; 14 ;

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   43.37
  • LogP   3.3389
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   6

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