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N-(3-methylpyridin-2-yl)formamide

  • CAS No. 4931-46-8

  • Cat. No. CS-0558819
  • Purity≥98%
  • MDL No.None

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

N-(3-methylpyridin-2-yl)formamide|CS-0558819

Structure of 4931-46-8

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General Information

  • CAS No. 4931-46-8
  • Cat. No. CS-0558819
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₈N₂O
  • Molecular Weight 136.15
  • Synonym(s) N-(3-Methyl-pyridin-2-yl)-formamide
  • SMILES CC1=C(N=CC=C1)NC=O

Synthesis

  • Route1

    References

    • E. I. du Pont de Nemours and Company; HOLYOKE JR, Caleb, William; TONG, My-Hanh, Thi; ZHANG, Wenming Patent: WO2012/106495 A1, 2012 ; Location in patent: Page/Page column 47-48 ;
  • Route2
    • N-(3-methylpyridin-2-yl)pivalamide|CS-0330778
      86847-66-7
    • ~%
    • N-(3-methylpyridin-2-yl)formamide|CS-0558819
      4931-46-8

    References

    • Van Zandt, Michael C.; Doan, Brian; Sawicki, Diane R.; Sredy, Janet; Podjarny, Alberto D. Bioorganic and Medicinal Chemistry Letters, 2009 , vol. 19, # 7 p. 2006 - 2008
  • Route3

    References

    • Ebetino, Frank H.; Berk, Jeffrey D. Journal of Organometallic Chemistry, 1997 , vol. 529, # 1-2 p. 135 - 142

Safety Information

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GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 1759
Class : 8
Packing Group : Ⅲ
Hazard Statements : H302-H315-H318-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   41.99
  • LogP   0.95832
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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