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CS-W001157 4
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Isopentyl octanoate

  • CAS No. 2035-99-6

  • Cat. No. CS-W014922
  • Purity≥98%
  • MDL No.MFCD00048917

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

Isopentyl octanoate|CS-W014922

Structure of 2035-99-6

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General Information

  • CAS No. 2035-99-6
  • Cat. No. CS-W014922
  • Purity ≥98%
  • MDL No. MFCD00048917
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₂₆O₂
  • Molecular Weight 214.35
  • Synonym(s) None
  • SMILES CCCCCCCC(OCCC(C)C)=O

Description

Intercalating within olfactory receptor binding pockets, Isoamyl octanoate (CAS 2035-99-6) elicits fruity ester perception in sensory assays via hydrophobic domain engagement.

Synthesis

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      123-51-3
    • In-stock
      Octanoic acid|CS-0016549
      124-07-2
    • ~%
    • In-stock
      Isopentyl octanoate|CS-W014922
      2035-99-6

    References

    • Journal of Agricultural and Food Chemistry, , vol. 54, # 7 p. 2695 - 2704
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      123-51-3
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      111-64-8
    • ~%
    • In-stock
      Isopentyl octanoate|CS-W014922
      2035-99-6

    References

    • Journal of the Chemical Society, , p. 2416,2418

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315
Precautionary Statements : P264-P280-P302+P352-P332+P313-P362+P364

Quality Control

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   3.9362
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   9

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