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CS-W001157 4
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(E)-hex-2-en-1-yl hexanoate

  • CAS No. 53398-86-0

  • Cat. No. CS-0465772
  • Purity≥98%
  • MDL No.MFCD00036551

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

(E)-hex-2-en-1-yl hexanoate|CS-0465772

Structure of 53398-86-0

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General Information

  • CAS No. 53398-86-0
  • Cat. No. CS-0465772
  • Purity ≥98%
  • MDL No. MFCD00036551
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₂₂O₂
  • Molecular Weight 198.30
  • Synonym(s) Hexanoic Acid trans-2-Hexenyl Ester
  • SMILES CCC/C=C/COC(=O)CCCCC

Synthesis

  • Route1
    • (E)-Hex-2-en-1-ol, ≥95%|CS-1269183
      928-95-0
    • null|null
      142-62-1
    • ~35%
    • (E)-hex-2-en-1-yl hexanoate|CS-0465772
      53398-86-0

    References

    • Liaquat, Muhammad Journal of Molecular Catalysis B: Enzymatic, 2011 , vol. 68, # 1 p. 59 - 65

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   3.4662
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   8

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