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CS-W001157 4
Total: USD 88.00

N-(tert-Butyl)isonicotinamide

  • CAS No. 65321-30-4

  • Cat. No. CS-0187549
  • Molecule weight178.23
  • Purity≥98%
  • MDL No.None

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

N-(tert-Butyl)isonicotinamide|CS-0187549

Structure of 65321-30-4

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General Information

  • CAS No. 65321-30-4
  • Cat. No. CS-0187549
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₄N₂O
  • Molecular Weight 178.23
  • Synonym(s) N-tert-Butylisonicotinamide
  • SMILES CC(C)(C)NC(=O)C1=CC=NC=C1

Synthesis

  • Route1
    • Isonicotinic acid Nicotinic Acid  Impurity|CS-0229405
      55-22-1
    • null|null
      541-41-3
    • null|null
      75-64-9
    • ~68%
    • N-(tert-Butyl)isonicotinamide|CS-0187549
      65321-30-4

    References

    • NOVARTIS AG Patent: WO2008/122615 A1, 2008 ; Location in patent: Page/Page column 50 ; WO 2008/122615 A1
  • Route2

    References

    • Kalkhambkar, Rajesh G.; Waters, Sarah N.; Laali, Kenneth K. Tetrahedron Letters, 2011 , vol. 52, # 8 p. 867 - 871
  • Route3

    References

    • Sumitomo Pharmaceuticals Company, Limited Patent: US6384033 B1, 2002 ;

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-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   41.99
  • LogP   1.6099
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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