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CS-W001157 4
Total: USD 88.00

5-Hexenyl acetate

  • CAS No. 5048-26-0

  • Cat. No. CS-0204797
  • Purity≥98%
  • MDL No.MFCD00060856

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

5-Hexenyl acetate|CS-0204797

Structure of 5048-26-0

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General Information

  • CAS No. 5048-26-0
  • Cat. No. CS-0204797
  • Purity ≥98%
  • MDL No. MFCD00060856
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₄O₂
  • Molecular Weight 142.20
  • Synonym(s) hex-5-en-1-yl acetate
  • SMILES O=C(OCCCCC=C)C

Synthesis

  • Route1

    References

    • MERCK FROSST CANADA and CO. Patent: WO2005/70874 A1, 2005 ; Location in patent: Page/Page column 24 ;
  • Route2

    References

    • Vilaca, Gil; Rubio, Cyril; Susperregui, Jacques; Latxague, Laurent; Deleris, Gerard Tetrahedron, 2002 , vol. 58, # 45 p. 9249 - 9256
  • Route3

    References

    • Grasa, Gabriela A.; Gueveli, Tatyana; Singh, Rohit; Nolan, Steven P. Journal of Organic Chemistry, 2003 , vol. 68, # 7 p. 2812 - 2819

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS02
Signal Word : Danger
UN#: 3272
Class : 3
Packing Group : Ⅲ
Hazard Statements : H225
Precautionary Statements : P210-P233-P240-P241-P242-P243-P280-P370+P378-P501

Quality Control

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   1.9058
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   5

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