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CS-W001157 4
Total: USD 88.00

2-(Cyano(4-fluorophenyl)methyl)benzonitrile

  • CAS No. 116617-31-3

  • Cat. No. CS-0335189
  • Purity95+%
  • MDL No.None

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

2-(Cyano(4-fluorophenyl)methyl)benzonitrile|CS-0335189

Structure of 116617-31-3

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General Information

  • CAS No. 116617-31-3
  • Cat. No. CS-0335189
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₉FN₂
  • Molecular Weight 236.24
  • Synonym(s) 2-[CYANO(4-FLUOROPHENYL)METHYL]BENZENECARBONITRILE
  • SMILES C1=CC=C(C(=C1)C#N)C(C#N)C2=CC=C(C=C2)F

Synthesis

  • Route1

    References

    • Bech Sommer, Michael; Begtrup, Mikael; Boegesoe, Klaus Peter Journal of Organic Chemistry, 1990 , vol. 55, # 16 p. 4817 - 4821

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   47.58
  • LogP   3.35286
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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