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CS-W001157 4
Total: USD 88.00

Diethyl 3-oxopentanedioate

  • CAS No. 105-50-0

  • Cat. No. CS-W015515
  • Purity≥95%
  • MDL No.MFCD00009200

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

Diethyl 3-oxopentanedioate|CS-W015515

Structure of 105-50-0

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General Information

  • CAS No. 105-50-0
  • Cat. No. CS-W015515
  • Purity ≥95%
  • MDL No. MFCD00009200
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₄O₅
  • Molecular Weight 202.21
  • Synonym(s) None
  • SMILES O=C(OCC)CC(CC(OCC)=O)=O

Description

5-Bromo-6-methylpyridin-2-amine is used in a variety of scientific research applications. It is an important building block in organic synthesis, and is used in the synthesis of a range of small molecules, including pharmaceuticals, agrochemicals, and natural products. 5-Bromo-6-methylpyridin-2-amine is also used in biochemical and physiological studies, as well as for use in laboratory experiments. It has been used in the synthesis of a number of biologically active compounds, including inhibitors of the enzyme cyclooxygenase-2 . It has also been used in the synthesis of a number of compounds that have been shown to have anti-cancer activity.

Synthesis

  • Route1

    References

    • Poldy, Jacqueline; Barrow, Russell A.; Peakall, Rod European Journal of Organic Chemistry, 2012 , # 29 p. 5818 - 5827,10
  • Route2

    References

    • Poldy, Jacqueline; Peakall, Rod; Barrow, Russell A. European Journal of Organic Chemistry, 2012 , # 29 p. 5818 - 5827
  • Route3

    References

    • Justus Liebigs Annalen der Chemie, , vol. 422, p. 11 Journal of the Chemical Society, , vol. 121, p. 1644 Organic Syntheses 5 <New York 1925>, S. 53

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-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   69.67
  • LogP   0.4619
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   6

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