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CS-W001157 4
Total: USD 88.00

3-Acetylheptane-2,6-dione

  • CAS No. 29214-57-1

  • Cat. No. CS-0359713
  • Purity≥95%
  • MDL No.None

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

3-Acetylheptane-2,6-dione|CS-0359713

Structure of 29214-57-1

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General Information

  • CAS No. 29214-57-1
  • Cat. No. CS-0359713
  • Purity ≥95%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₄O₃
  • Molecular Weight 170.21
  • Synonym(s) 3-acetyl-heptane-2,6-dione
  • SMILES CC(C(C(C)=O)CCC(C)=O)=O

Synthesis

  • Route1
    • null|null
      78-94-4
    • null|null
      123-54-6
    • ~97%
    • 3-Acetylheptane-2,6-dione|CS-0359713
      29214-57-1

    References

    • Bartoli, Giuseppe; Bosco, Marcella; Bellucci, Maria Cristina; Marcantoni, Enrico; Sambri, Letizia; Torregiani, Elisabetta European Journal of Organic Chemistry, 1999 , # 3 p. 617 - 620
  • Route2
    • null|null
      598-32-3
    • null|null
      123-54-6
    • ~83%
    • 3-Acetylheptane-2,6-dione|CS-0359713
      29214-57-1

    References

    • Yoo, Woo-Jin; Miyamura, Hiroyuki; Kobayashi, Shu Journal of the American Chemical Society, 2011 , vol. 133, # 9 p. 3095 - 3103
  • Route3

    References

    • Allais, Christophe; Lieby-Muller, Frederic; Rodriguez, Jean; Constantieux, Thierry European Journal of Organic Chemistry, 2013 , # 19 p. 4131 - 4145

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-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   51.21
  • LogP   1.1498
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   5

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