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CS-W001157 4
Total: USD 88.00

Ethyl 2-oxo-2-(2-oxocycloheptyl)acetate

  • CAS No. 29800-43-9

  • Cat. No. CS-0255104
  • Purity≥96%
  • MDL No.None

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

Ethyl 2-oxo-2-(2-oxocycloheptyl)acetate|CS-0255104

Structure of 29800-43-9

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General Information

  • CAS No. 29800-43-9
  • Cat. No. CS-0255104
  • Purity ≥96%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₆O₄
  • Molecular Weight 212.24
  • Synonym(s) Oxo-(2-oxo-cycloheptyl)-acetic acid ethyl ester
  • SMILES O=C(C(C1C(CCCCC1)=O)=O)OCC

Synthesis

  • Route1
    • null|null
      95-92-1
    • null|null
      502-42-1
    • ~86%
    • Ethyl 2-oxo-2-(2-oxocycloheptyl)acetate|CS-0255104
      29800-43-9

    References

    • Wu, Deyan; Jin, Fangfang; Lu, Weiqiang; Zhu, Jin; Li, Cui; Wang, Wei; Tang, Yun; Jiang, Hualiang; Huang, Jin; Liu, Guixia; Li, Jian Chemical Biology and Drug Design, 2012 , vol. 79, # 6 p. 897 - 906

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   60.44
  • LogP   1.268
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   3

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