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CS-W001157 4
Total: USD 88.00

Ethyl 5-oxohexanoate

  • CAS No. 13984-57-1

  • Cat. No. CS-W010896
  • Purity≥97%
  • MDL No.MFCD00009213

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

Ethyl 5-oxohexanoate|CS-W010896

Structure of 13984-57-1

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General Information

  • CAS No. 13984-57-1
  • Cat. No. CS-W010896
  • Purity ≥97%
  • MDL No. MFCD00009213
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₄O₃
  • Molecular Weight 158.20
  • Synonym(s) Hexanoic acid, 5-oxo-, ethyl ester
  • SMILES O=C(OCC)CCCC(C)=O

Synthesis

  • Route1
    • null|null
      34495-74-4
    • ~50%
    • In-stock
      Ethyl 5-oxohexanoate|CS-W010896
      13984-57-1

    References

    • Kulkarni; Sebastian Synthetic Communications, 1991 , vol. 21, # 4 p. 581 - 586
  • Route2
    • 1,3-Diethyl 2-(3-Oxobutyl)propanedioate|CS-0741221
      4761-26-6
    • ~82%
    • In-stock
      Ethyl 5-oxohexanoate|CS-W010896
      13984-57-1

    References

    • Vig, O. P.; Sharma, M. L.; Verma, N. K. Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1982 , vol. 21, # 4 p. 384 - 385
  • Route3
    • null|null
      28483-60-5
    • null|null
      140-88-5
    • ~15%
    • In-stock
      Ethyl 5-oxohexanoate|CS-W010896
      13984-57-1

    References

    • Yasuda, Makoto; Chiba, Kouji; Ohigashi, Noriyuki; Katoh, Yasuhiro; Baba, Akio Journal of the American Chemical Society, 2003 , vol. 125, # 24 p. 7291 - 7300

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   43.37
  • LogP   1.3088
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   5

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