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CS-W001157 4
Total: USD 88.00

5-(1,3-Dioxolan-2-yl)picolinonitrile

  • CAS No. 671776-91-3

  • Cat. No. CS-0179617
  • Purity≥98%
  • MDL No.MFCD20278069

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

5-(1,3-Dioxolan-2-yl)picolinonitrile|CS-0179617

Structure of 671776-91-3

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General Information

  • CAS No. 671776-91-3
  • Cat. No. CS-0179617
  • Purity ≥98%
  • MDL No. MFCD20278069
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈N₂O₂
  • Molecular Weight 176.17
  • Synonym(s) 5-(1,3-dioxolan-2-yl)pyridine-2-carbonitrile
  • SMILES N#CC1=NC=C(C2OCCO2)C=C1

Synthesis

  • Route1
    • null|null
      73963-98-1
    • 2-Bromo-5-(1,3-dioxolan-2-yl)pyridine|CS-0312257
      220904-17-6
    • ~42%
    • In-stock
      5-(1,3-Dioxolan-2-yl)picolinonitrile|CS-0179617
      671776-91-3

    References

    • BAYER HEALTHCARE AG Patent: WO2004/24700 A1, 2004 ; Location in patent: Page 34 ; WO 2004/024700 A1
  • Route2
    • null|null
      557-21-1
    • 2-Bromo-5-(1,3-dioxolan-2-yl)pyridine|CS-0312257
      220904-17-6
    • ~76%
    • In-stock
      5-(1,3-Dioxolan-2-yl)picolinonitrile|CS-0179617
      671776-91-3

    References

    • Kyowa Hakko Kirin Co., Ltd.; Fukuda, Yuichi; Kanai, Toshimi; Nakasato, Yoshisuke; Kimpara, Keisuke Patent: US2013/65905 A1, 2013 ; Location in patent: Paragraph 0181 ;
  • Route3

    References

    • Kyowa Hakko Kirin Co., Ltd.; Fukuda, Yuichi; Kanai, Toshimi; Nakasato, Yoshisuke; Kimpara, Keisuke Patent: US2013/65905 A1, 2013 ;

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-P280-P302+P352

Quality Control

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Computational Chemistry Data

  • TPSA   55.14
  • LogP   0.99868
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   1

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