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3-Acetyl-5-hydroxy-4,5-dimethyl-1H-pyrrol-2(5H)-one

  • CAS No. 98593-79-4

  • Cat. No. CS-0534791
  • Purity≥98%
  • MDL No.MFCD00138600

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

3-Acetyl-5-hydroxy-4,5-dimethyl-1H-pyrrol-2(5H)-one|CS-0534791

Structure of 98593-79-4

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General Information

  • CAS No. 98593-79-4
  • Cat. No. CS-0534791
  • Purity ≥98%
  • MDL No. MFCD00138600
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₁NO₃
  • Molecular Weight 169.18
  • Synonym(s) 3-Acetyl-4,5-dimethyl-5-hydroxy-1,5-dihydro-2h-pyrrol-2-one
  • SMILES O=C1NC(C(C)=C1C(C)=O)(C)O

Synthesis

  • Route1

    References

    • Journal of the American Chemical Society, , vol. 81, p. 4355

Safety Information

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Computational Chemistry Data

  • TPSA   66.4
  • LogP   -0.2698
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   1

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