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2-Oxo-1h,2h,5h,6h,7h-cyclopenta[b]pyridine-3-carbonitrile

  • CAS No. 108106-97-4

  • Cat. No. CS-0259528
  • Purity≥98%
  • MDL No.None

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

2-Oxo-1h,2h,5h,6h,7h-cyclopenta[b]pyridine-3-carbonitrile|CS-0259528

Structure of 108106-97-4

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General Information

  • CAS No. 108106-97-4
  • Cat. No. CS-0259528
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈N₂O
  • Molecular Weight 160.17
  • Synonym(s) 2-oxo-2,5,6,7-tetrahydro-1H-cyclopenta[b]pyridine-3-carbonitrile
  • SMILES C1CC2=CC(=C(N=C2C1)O)C#N

Synthesis

  • Route1
    • null|null
      120-92-3
    • ~%
    • 2-Oxo-1h,2h,5h,6h,7h-cyclopenta[b]pyridine-3-carbonitrile|CS-0259528
      108106-97-4

    References

    • Paine, John B. Journal of Heterocyclic Chemistry, 1987 , vol. 24, p. 351 - 355
  • Route2
    • Carbamoyl cyanide Diphenoxylate Impurity|CS-0531732
      4370-12-1
    • null|null
      120-92-3
    • null|null
      109-94-4
    • ~%
    • 2-Oxo-1h,2h,5h,6h,7h-cyclopenta[b]pyridine-3-carbonitrile|CS-0259528
      108106-97-4

    References

    • Fischer, Christian B.; Polborn, Kurt; Steininger, Harald; Zipse, Hendrik Zeitschrift fur Naturforschung - Section B Journal of Chemical Sciences, 2004 , vol. 59, # 10 p. 1121 - 1131

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-H312-H315-H319-H332-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   56.91
  • LogP   1.14758
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   0

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