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CS-W001157 4
Total: USD 88.00

5,5-Dimethyl-4-oxohexanoic acid

  • CAS No. 57965-24-9

  • Cat. No. CS-0465728
  • Molecule weight158.19
  • Purity≥98%
  • MDL No.MFCD01320155

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

5,5-Dimethyl-4-oxohexanoic acid|CS-0465728

Structure of 57965-24-9

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General Information

  • CAS No. 57965-24-9
  • Cat. No. CS-0465728
  • Purity ≥98%
  • MDL No. MFCD01320155
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₄O₃
  • Molecular Weight 158.19
  • Synonym(s) None
  • SMILES CC(C)(C)C(=O)CCC(=O)O

Synthesis

  • Route1
    • null|null
      1384959-27-6
    • ~76%
    • 5,5-Dimethyl-4-oxohexanoic acid|CS-0465728
      57965-24-9

    References

    • Sedlacek, Ondrej; Hruby, Martin; Studenovsky, Martin; Vetvicka, David; Svoboda, Jan; Kankova, Dana; Kovar, Jan; Ulbrich, Karel Bioorganic and Medicinal Chemistry, 2012 , vol. 20, # 13 p. 4056 - 4063
  • Route2
    • null|null
      77903-42-5
    • ~86%
    • 5,5-Dimethyl-4-oxohexanoic acid|CS-0465728
      57965-24-9

    References

    • Kunkel, Elisabeth; Reichelt, Ingrid; Reissig, Hans-Ulrich Liebigs Annalen der Chemie, 1984 , # 4 p. 802 - 819
  • Route3
    • null|null
      344309-16-6
    • ~%
    • 5,5-Dimethyl-4-oxohexanoic acid|CS-0465728
      57965-24-9

    References

    • Chemische Berichte, , vol. 116, # 1 p. 220 - 229

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   54.37
  • LogP   1.4664
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   3

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