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CS-W001157 4
Total: USD 88.00

Ibuprofen impurity 1

  • CAS No. 3585-47-5

  • Cat. No. CS-0131910
  • Purity≥98%
  • MDL No.None

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

Ibuprofen impurity 1|CS-0131910

Structure of 3585-47-5

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General Information

  • CAS No. 3585-47-5
  • Cat. No. CS-0131910
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₆O₂
  • Molecular Weight 192.25
  • Synonym(s) None
  • SMILES O=C(O)C(C)C1=CC=C(CCC)C=C1

Synthesis

  • Route1
    • 2-Chloro-1-(4-propylphenyl)propan-1-one|CS-0220037
      132560-67-9
    • ~83%
    • Ibuprofen impurity 1|CS-0131910
      3585-47-5

    References

    • Sonawane, Harikisan R.; Kulkarni, Dilip G.; Ayyangar, Nagaraj R. Tetrahedron Letters, 1990 , vol. 31, # 51 p. 7495 - 7496
  • Route2
    • 2-Chloro-1-(4-propylphenyl)propan-1-one|CS-0220037
      132560-67-9
    • ~86%
    • Ibuprofen impurity 1|CS-0131910
      3585-47-5
    • 1-(4-Propylphenyl)propan-1-one|CS-0314697
      56147-30-9

    References

    • Tetrahedron, , vol. 50, # 4 p. 1243 - 1260

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-H312-H332
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P363-P501

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   2.8272
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   4

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