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CS-W001157 4
Total: USD 88.00

4-Oxohexanoic acid

  • CAS No. 1117-74-4

  • Cat. No. CS-0207493
  • Purity98+%
  • MDL No.MFCD00068854

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

4-Oxohexanoic acid|CS-0207493

Structure of 1117-74-4

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General Information

  • CAS No. 1117-74-4
  • Cat. No. CS-0207493
  • Purity 98+%
  • MDL No. MFCD00068854
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₁₀O₃
  • Molecular Weight 130.14
  • Synonym(s) Homolevulinic acid
  • SMILES CCC(=O)CCC(=O)O

Synthesis

  • Route1
    • null|null
      925-90-6
    • null|null
      543-20-4
    • ~%
    • 4-Oxohexanoic acid|CS-0207493
      1117-74-4

    References

    • Journal of Organic Chemistry, , vol. 23, p. 1668,1670, 1672
  • Route2

    References

    • Singh; Verma Synthetic Communications, 2004 , vol. 34, # 24 p. 4471 - 4475
  • Route3

    References

    • Green Chemistry, , vol. 15, # 1 p. 85 - 90

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   0.8303
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   4

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