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6-(3-Formylphenyl)nicotinonitrile

  • CAS No. 769972-01-2

  • Cat. No. CS-0455558
  • Molecule weight208.22
  • Purity≥98%
  • MDL No.None

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

6-(3-Formylphenyl)nicotinonitrile|CS-0455558

Structure of 769972-01-2

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General Information

  • CAS No. 769972-01-2
  • Cat. No. CS-0455558
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₈N₂O
  • Molecular Weight 208.22
  • Synonym(s) 3-(3-Cyanopyridin-2-yl)benzaldehyde
  • SMILES C1=CC(=CC(=C1)C2=NC=C(C=C2)C#N)C=O

Synthesis

  • Route1

    References

    • Ismail, Mohamed A.; Brun, Reto; Wenzler, Tanja; Tanious, Farial A.; Wilson, W. David; Boykin, David W. Bioorganic and Medicinal Chemistry, 2004 , vol. 12, # 20 p. 5405 - 5413

Safety Information

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GHS Pictogram : N/A
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UN#: N/A
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Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   53.75
  • LogP   2.43278
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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