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CS-W001157 4
Total: USD 88.00

Hexyl 3-oxobutanoate

  • CAS No. 13562-84-0

  • Cat. No. CS-0445427
  • Molecule weight186.25
  • Purity≥98%
  • MDL No.None

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

Hexyl 3-oxobutanoate|CS-0445427

Structure of 13562-84-0

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General Information

  • CAS No. 13562-84-0
  • Cat. No. CS-0445427
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₈O₃
  • Molecular Weight 186.25
  • Synonym(s) Hexyl acetoacetate
  • SMILES CCCCCCOC(=O)CC(=O)C

Synthesis

  • Route1

    References

    • Bandgar; Sadavarte; Uppalla Journal of Chemical Research - Part S, 2001 , # 1 p. 16 - 17
  • Route2

    References

    • Kobayashi; Inoue; Nishino; Fujihara; Oizumi; Kimura Chemical and Pharmaceutical Bulletin, 1995 , vol. 43, # 5 p. 797 - 817
  • Route3

    References

    • Koval; Dzyuba; Ilnitska; Pekhnyo Tetrahedron Letters, 2008 , vol. 49, # 10 p. 1645 - 1647

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H227-H315-H319
Precautionary Statements : P210-P264-P280-P302+P352-P362+P364-P370+P378-P403-P501

Quality Control

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Computational Chemistry Data

  • TPSA   43.37
  • LogP   2.089
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   7

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