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CS-W001157 4
Total: USD 88.00

2-(tert-Butyl)-6-hydroxypyrimidin-4(3H)-one

  • CAS No. 18378-79-5

  • Cat. No. CS-0432823
  • Purity≥98%
  • MDL No.None

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

2-(tert-Butyl)-6-hydroxypyrimidin-4(3H)-one|CS-0432823

Structure of 18378-79-5

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General Information

  • CAS No. 18378-79-5
  • Cat. No. CS-0432823
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₂N₂O₂
  • Molecular Weight 168.19
  • Synonym(s) 2-Tert-butyl-4,6-dihydroxypyrimidine
  • SMILES O=C1NC(C(C)(C)C)=NC(O)=C1

Synthesis

  • Route1

    References

    • Altenbach, Robert J.; Adair, Ronald M.; Bettencourt, Brian M.; Black, Lawrence A.; Fix-Stenzel, Shannon R.; Gopalakrishnan, Sujatha M.; Hsieh, Gin C.; Liu, Huaqing; Marsh, Kennan C.; McPherson, Michael J.; Milicic, Ivan; Miller, Thomas R.; Vortherms, Timothy A.; Warrior, Usha; Wetter, Jill M.; Wishart, Neil; Witte, David G.; Honore, Prisca; Esbenshade, Timothy A.; Hancock, Arthur A.; Brioni, Jorge D.; Cowart, Marlon D. Journal of Medicinal Chemistry, 2008 , vol. 51, # 20 p. 6571 - 6580

Safety Information

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Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   65.98
  • LogP   0.773
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   0

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