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CS-W001157 4
Total: USD 88.00

4-(4-Chlorophenyl)-3-methyl-4-oxobutanoic acid

  • CAS No. 52240-25-2

  • Cat. No. CS-0232137
  • Molecule weight226.66
  • Purity≥97%
  • MDL No.MFCD00156903

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

4-(4-Chlorophenyl)-3-methyl-4-oxobutanoic acid|CS-0232137

Structure of 52240-25-2

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General Information

  • CAS No. 52240-25-2
  • Cat. No. CS-0232137
  • Purity ≥97%
  • MDL No. MFCD00156903
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₁ClO₃
  • Molecular Weight 226.66
  • Synonym(s) benzenebutanoic acid, 4-chloro-beta-methyl-gamma-oxo-
  • SMILES CC(CC(=O)O)C(=O)C1=CC=C(C=C1)Cl

Synthesis

  • Route1
    • null|null
      53012-96-7
    • ~53%
    • In-stock
      4-(4-Chlorophenyl)-3-methyl-4-oxobutanoic acid|CS-0232137
      52240-25-2

    References

    • Jonas, R; Klockow, M; Lues, I; Pruecher, H; Schliep, H J; Wurziger, H European Journal of Medicinal Chemistry, 1993 , vol. 28, # 2 p. 129 - 140
  • Route2

    References

    • Jonas, R; Klockow, M; Lues, I; Pruecher, H; Schliep, H J; Wurziger, H European Journal of Medicinal Chemistry, 1993 , vol. 28, # 2 p. 129 - 140
  • Route3
    • null|null
      6285-05-8
    • ~%
    • In-stock
      4-(4-Chlorophenyl)-3-methyl-4-oxobutanoic acid|CS-0232137
      52240-25-2

    References

    • Puterbaugh; Readshaw Chemistry and Industry (London, United Kingdom), 1959 , p. 255 Journal of the American Chemical Society, 1960 , vol. 82, p. 3635,3636, 3637

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319
Precautionary Statements : P264-P280-P302+P352-P362+P364

Quality Control

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Computational Chemistry Data

  • TPSA   54.37
  • LogP   2.6335
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   4

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