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CS-W001157 4
Total: USD 88.00

1-(4-Fluorophenyl)cyclohexanecarbonitrile

  • CAS No. 71486-43-6

  • Cat. No. CS-0207113
  • Purity≥98%
  • MDL No.MFCD00800617

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

1-(4-Fluorophenyl)cyclohexanecarbonitrile|CS-0207113

Structure of 71486-43-6

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General Information

  • CAS No. 71486-43-6
  • Cat. No. CS-0207113
  • Purity ≥98%
  • MDL No. MFCD00800617
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₄FN
  • Molecular Weight 203.26
  • Synonym(s) None
  • SMILES C1CCC(CC1)(C#N)C2=CC=C(C=C2)F

Synthesis

  • Route1
    • null|null
      111-24-0
    • In-stock
      4-Fluorophenylacetonitrile|CS-W020067
      459-22-3
    • ~70%
    • In-stock
      1-(4-Fluorophenyl)cyclohexanecarbonitrile|CS-0207113
      71486-43-6

    References

    • Watanuki, Susumu; Matsuura, Keisuke; Tomura, Yuichi; Okada, Minoru; Okazaki, Toshio; Ohta, Mitsuaki; Tsukamoto, Shin-Ichi Bioorganic and Medicinal Chemistry, 2011 , vol. 19, # 18 p. 5628 - 5638
  • Route2

    References

    • Journal of the American Chemical Society, , vol. 135, # 34 p. 12576 - 12579

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-H315-H319-H332-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   23.79
  • LogP   3.55118
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   1

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