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CS-W001157 4
Total: USD 88.00

1-Phenyl-2-(pyrazin-2-yl)ethan-1-one

  • CAS No. 40061-45-8

  • Cat. No. CS-0327449
  • Molecule weight198.22
  • Purity95+%
  • MDL No.None

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

1-Phenyl-2-(pyrazin-2-yl)ethan-1-one|CS-0327449

Structure of 40061-45-8

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General Information

  • CAS No. 40061-45-8
  • Cat. No. CS-0327449
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₀N₂O
  • Molecular Weight 198.22
  • Synonym(s) 1-Phenyl-2-pyrazin-2-ylethanone
  • SMILES C1=CC=C(C=C1)C(=O)CC2=CN=CC=N2

Synthesis

  • Route1

    References

    • Ferring-Research Limited; Yamanouchi Pharmaceutical Co. Ltd. Patent: US5728829 A1, 1998 ;
  • Route2

    References

    • Behun; Levine Journal of the American Chemical Society, 1959 , vol. 81, p. 5157
  • Route3

    References

    • Carver, David R.; Komin, Andrew P.; Hubbard, James S.; Wolfe, James S. Journal of Organic Chemistry, 1981 , vol. 46, # 2 p. 294 - 299

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05
Signal Word : Danger
UN#: 1759
Class : 8
Packing Group : Ⅲ
Hazard Statements : H290-H314
Precautionary Statements : P234-P260-P264-P280-P301+P330+P331-P304+P340-P363-P390-P405-P406-P501

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Computational Chemistry Data

  • TPSA   42.85
  • LogP   1.902
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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