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CS-W001157 4
Total: USD 88.00

3-Bromoisonicotinonitrile

  • CAS No. 13958-98-0

  • Cat. No. CS-W002552
  • Purity≥98%
  • MDL No.MFCD00234143

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

3-Bromoisonicotinonitrile|CS-W002552

Structure of 13958-98-0

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General Information

  • CAS No. 13958-98-0
  • Cat. No. CS-W002552
  • Purity ≥98%
  • MDL No. MFCD00234143
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₃BrN₂
  • Molecular Weight 183.01
  • Synonym(s) 3-Bromo-4-pyridinecarbonitrile
  • SMILES N#Cc1ccncc1Br

Synthesis

  • Route1
    • null|null
      927806-21-1
    • ~86%
    • In-stock
      3-Bromoisonicotinonitrile|CS-W002552
      13958-98-0

    References

    • Miknis, Greg; Lyssikatos, Joseph P.; Laird, Ellen; Tarlton, Eugene; Buckmelter, Alexandre J.; Ren, Li; Rast, Bryson; Schlacter, Stephen T.; Wenglowsky, Steven Mark Patent: US2007/49603 A1, 2007 ; Location in patent: Page/Page column 38 ; US 20070049603 A1
  • Route2

    References

    • Dunn Organic Preparations and Procedures International, 1997 , vol. 29, # 5 p. 577 - 579
  • Route3

    References

    • Chang, Ching-Yao; Liu, Hui-Ming; Hsu, Ru-Ting Tetrahedron, 2009 , vol. 65, # 4 p. 748 - 751

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301
Precautionary Statements : P264-P270-P330-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   36.68
  • LogP   1.71578
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   0

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