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CS-W001157 4
Total: USD 88.00

(E)-3,7-dimethylocta-2,6-dien-1-yl benzoate

  • CAS No. 94-48-4

  • Cat. No. CS-0545881
  • Purity≥98%
  • MDL No.None

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

(E)-3,7-dimethylocta-2,6-dien-1-yl benzoate|CS-0545881

Structure of 94-48-4

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General Information

  • CAS No. 94-48-4
  • Cat. No. CS-0545881
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₇H₂₂O₂
  • Molecular Weight 258.36
  • Synonym(s) Geranyl benzoate
  • SMILES CC(=CCC/C(=C/COC(=O)C1=CC=CC=C1)/C)C

Synthesis

  • Route1

    References

    • Ram, Ram N.; Soni, Vineet Kumar; Gupta, Dharmendra Kumar Tetrahedron, 2012 , vol. 68, # 44 p. 9068 - 9075
  • Route2

    References

    • Moore, Joel D.; Byrne, Robert J.; Vedantham, Punitha; Flynn, Daniel L.; Hanson, Paul R. Organic Letters, 2003 , vol. 5, # 23 p. 4241 - 4244
  • 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 : 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

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   4.5361
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   6

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