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CS-W001157 4
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4-(4-Chlorophenyl)-1-(1H-imidazol-1-yl)butan-2-ol

  • CAS No. 67085-11-4

  • Cat. No. CS-0157541
  • Molecule weight250.72
  • Purity≥98%
  • MDL No.MFCD09751154

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

4-(4-Chlorophenyl)-1-(1H-imidazol-1-yl)butan-2-ol|CS-0157541

Structure of 67085-11-4

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General Information

  • CAS No. 67085-11-4
  • Cat. No. CS-0157541
  • Purity ≥98%
  • MDL No. MFCD09751154
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₅ClN₂O
  • Molecular Weight 250.72
  • Synonym(s) 1-[4-(4-Chlorophenyl)-2-hydroxyl-butyl]imidazole
  • SMILES C1=C(C=CC(=C1)Cl)CCC(CN2C=CN=C2)O

Synthesis

  • Route1
    • Imidazole Ondansetron Impurity|CS-0229601
      288-32-4
    • 1-Chloro-4-(4-chlorophenyl)butan-2-ol|CS-0668175
      59363-13-2
    • ~83%
    • 4-(4-Chlorophenyl)-1-(1H-imidazol-1-yl)butan-2-ol|CS-0157541
      67085-11-4

    References

    • RICHTER GEDEON VEGYESZETI GYAR RT. Patent: WO2005/70897 A1, 2005 ; Location in patent: Page/Page column 7 ;
  • Route2
    • null|null
      104-83-6
    • ~%
    • 4-(4-Chlorophenyl)-1-(1H-imidazol-1-yl)butan-2-ol|CS-0157541
      67085-11-4

    References

    • Bioorganic and Medicinal Chemistry, , vol. 15, # 9 p. 3225 - 3234

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

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Computational Chemistry Data

  • TPSA   38.05
  • LogP   2.5302
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   5

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