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CS-W001157 4
Total: USD 88.00

4-(2-Fluorophenyl)tetrahydro-2h-pyran-4-carbonitrile

  • CAS No. 859164-45-7

  • Cat. No. CS-0269523
  • Molecule weight205.23
  • Purity95+%
  • MDL No.None

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

4-(2-Fluorophenyl)tetrahydro-2h-pyran-4-carbonitrile|CS-0269523

Structure of 859164-45-7

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General Information

  • CAS No. 859164-45-7
  • Cat. No. CS-0269523
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₂FNO
  • Molecular Weight 205.23
  • Synonym(s) 4-(2-fluorophenyl)oxane-4-carbonitrile
  • SMILES C1=CC=C(C(=C1)C2(CCOCC2)C#N)F

Synthesis

  • Route1

    References

    • ELI LILLY AND COMPANY Patent: WO2005/66126 A1, 2005 ; Location in patent: Page/Page column 43-44 ; WO 2005/066126 A1

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 3439
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-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   33.02
  • LogP   2.39748
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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