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CS-W001157 4
Total: USD 88.00

2-((4-Chlorobenzyl)oxy)-6-fluorobenzonitrile

  • CAS No. 175204-10-1

  • Cat. No. CS-0324159
  • Molecule weight261.68
  • Purity≥97%
  • MDL No.None

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

2-((4-Chlorobenzyl)oxy)-6-fluorobenzonitrile|CS-0324159

Structure of 175204-10-1

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General Information

  • CAS No. 175204-10-1
  • Cat. No. CS-0324159
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₉ClFNO
  • Molecular Weight 261.68
  • Synonym(s) 2-Fluoro-6-(4-chlorobenzyloxy)benzonitrile
  • SMILES C1=CC(=C(C#N)C(=C1)OCC2=CC=C(C=C2)Cl)F

Synthesis

  • Route1

    References

    • Thurmond, John; Butchbach, Matthew E. R.; Palomo, Marty; Pease, Brian; Rao, Munagala; Bedell, Louis; Keyvan, Monica; Pai, Grace; Mishra, Rama; Haraldsson, Magnus; Andresson, Thorkell; Bragason, Gisli; Thosteinsdottir, Margret; Bjornsson, Jon Mar; Coovert, Daniel D.; Burghes, Arthur H. M.; Gurney, Mark E.; Singh, Jasbir Journal of Medicinal Chemistry, 2008 , vol. 51, # 3 p. 449 - 469

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 3439
Class : 6.1
Packing Group : Ⅰ
Hazard Statements : H301+H311+H331
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P361+P364-P405-P501

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Computational Chemistry Data

  • TPSA   33.02
  • LogP   3.92978
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   3

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