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CS-W001157 4
Total: USD 88.00

1-(4-Aminophenyl)hexan-1-one

  • CAS No. 38237-76-2

  • Cat. No. CS-0451993
  • Molecule weight191.27
  • Purity≥98%
  • MDL No.None

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

1-(4-Aminophenyl)hexan-1-one|CS-0451993

Structure of 38237-76-2

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General Information

  • CAS No. 38237-76-2
  • Cat. No. CS-0451993
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₇NO
  • Molecular Weight 191.27
  • Synonym(s) 4-Hexanoylaniline
  • SMILES CCCCCC(=O)C1=CC=C(C=C1)N

Synthesis

  • Route1

    References

    • Rennison, David; Conole, Daniel; Tingle, Malcolm D.; Yang, Junpeng; Eason, Charles T.; Brimble, Margaret A. Bioorganic and Medicinal Chemistry Letters, 2013 , vol. 23, # 24 p. 6629 - 6635
  • Route2
    • p-Nitrophenyl methyl ketone Clenbuterol  Impurity|CS-0229063
      100-19-6
    • null|null
      71-36-3
    • ~73%
    • 1-(4-Aminophenyl)hexan-1-one|CS-0451993
      38237-76-2
    • 1-(4-Aminophenyl)ethanone Clenbuterol Impurity|CS-0229065
      99-92-3

    References

    • Nemeth, Janos; Kiss, Arpad; Hell, Zoltan Tetrahedron Letters, 2013 , vol. 54, # 45 p. 6094 - 6096
  • Route3
    • null|null
      33228-41-0
    • ~%
    • 1-(4-Aminophenyl)hexan-1-one|CS-0451993
      38237-76-2

    References

    • Doub et al. Journal of the American Chemical Society, 1958 , vol. 80, p. 2205,2210 Full Text Show Details Ogawa Technology Reports of Kansai University, 1959 , # 1 p. 41,43, 44 Full Text Show Details Ishidate; Nambara Pharmaceutical Bulletin, 1953 , vol. 1, p. 290 Full Text Show Details Sugimoto et al. Yakugaku Zasshi, 1951 , vol. 71, p. 1161 Chem.Abstr., 1952 , p. 5011

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H315-H319
Precautionary Statements : P264-P270-P280-P302+P352-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   43.09
  • LogP   3.0318
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   5

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