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CS-W001157 4
Total: USD 88.00

Ethyl 4-Methyloctanoate

  • CAS No. 56196-53-3

  • Cat. No. CS-0197286
  • Molecule weight186.29
  • Purity≥90%
  • MDL No.MFCD02262189

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

Ethyl 4-Methyloctanoate|CS-0197286

Structure of 56196-53-3

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General Information

  • CAS No. 56196-53-3
  • Cat. No. CS-0197286
  • Purity ≥90%
  • MDL No. MFCD02262189
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₂₂O₂
  • Molecular Weight 186.29
  • Synonym(s) None
  • SMILES O=C(CCC(CCCC)C)OCC

Synthesis

  • Route1
    • null|null
      79909-21-0
    • null|null
      693-04-9
    • ~34%
    • In-stock
      Ethyl 4-Methyloctanoate|CS-0197286
      56196-53-3

    References

    • Vechorkin, Oleg; Hu, Xile Angewandte Chemie, International Edition, 2009 , vol. 48, p. 2937 - 2940 Angewandte Chemie, 2009 , vol. 121, p. 2981 - 2984
  • Route2
    • null|null
      18589-27-0
    • null|null
      140-88-5
    • ~90%
    • In-stock
      Ethyl 4-Methyloctanoate|CS-0197286
      56196-53-3

    References

    • Sim, Tae Bo; Choi, Jaesung; Joung, Meyoung Ju; Yoon, Nung Min Journal of Organic Chemistry, 1997 , vol. 62, # 8 p. 2357 - 2361
  • Route3
    • null|null
      944721-57-7
    • ~%
    • In-stock
      Ethyl 4-Methyloctanoate|CS-0197286
      56196-53-3

    References

    • Ragoussis, Valentine; Giannikopoulos, Alexandros; Skoka, Efthymia; Grivas, Panagiotis Journal of Agricultural and Food Chemistry, 2007 , vol. 55, # 13 p. 5050 - 5052

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   26.3
  • LogP   3.156
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   7

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