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CS-W001157 4
Total: USD 88.00

3-Methyl-2,4-pentanedione

  • CAS No. 815-57-6

  • Cat. No. CS-0095844
  • Purity≥97%
  • MDL No.None

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

3-Methyl-2,4-pentanedione|CS-0095844

Structure of 815-57-6

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General Information

  • CAS No. 815-57-6
  • Cat. No. CS-0095844
  • Purity ≥97%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₁₀O₂
  • Molecular Weight 114.14
  • Synonym(s) Methylacetylacetone
  • SMILES CC(C(C)C(C)=O)=O

Description

Peroxynitrite promoted aerobic oxidation of 3-methyl-2,4-pentanedione has been reported. The kinetics of the reaction of OH radicals with 3-methyl-2,4-pentanedione has been investigated in the gas-phase using a pulsed laser photolysis-laser induced fluorescence technique. 3-methyl-2,4-pentanedione participates in asymmetric substitution of 1,3-diphenyl-2-propenyl acetate catalyzed by amphiphilic resin-supported monodentate phosphine ligands.

Synthesis

  • Route1
    • null|null
      123-54-6
    • null|null
      74-88-4
    • ~94%
    • In-stock
      3-Methyl-2,4-pentanedione|CS-0095844
      815-57-6

    References

    • Arumugam, Subramaniam; McLeod, Dale; Verkade, John G. Journal of Organic Chemistry, 1998 , vol. 63, # 11 p. 3677 - 3679
  • Route2
    • null|null
      123-54-6
    • ~90%
    • In-stock
      3-Methyl-2,4-pentanedione|CS-0095844
      815-57-6

    References

    • Bayer Aktiengesellschaft Patent: US4567004 A1, 1986 ;
  • Route3
    • null|null
      50-00-0
    • null|null
      123-54-6
    • ~83%
    • In-stock
      3-Methyl-2,4-pentanedione|CS-0095844
      815-57-6

    References

    • Abe, Fujio; Hayashi, Teruyuki; Tanaka, Masato Chemistry Letters, 1990 , # 5 p. 765 - 768

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS02,GHS07
Signal Word : Warning
UN#: 1224
Class : 3
Packing Group : Ⅲ
Hazard Statements : H226-H315-H319-H335
Precautionary Statements : P210-P233-P240-P241-P242-P243-P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P370+P378-P405-P501

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Computational Chemistry Data

  • TPSA   34.14
  • LogP   0.8005
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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