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CS-W001157 4
Total: USD 88.00

Benzyl hexanoate

  • CAS No. 6938-45-0

  • Cat. No. CS-0454959
  • Molecule weight206.28
  • Purity≥98%
  • MDL No.None

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

Benzyl hexanoate|CS-0454959

Structure of 6938-45-0

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General Information

  • CAS No. 6938-45-0
  • Cat. No. CS-0454959
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₈O₂
  • Molecular Weight 206.28
  • Synonym(s) 3,4,5-trimethoxy-N-(2,3,5-trichloro-4-hydroxyphenyl)benzamide
  • SMILES CCCCCC(=O)OCC1=CC=CC=C1

Synthesis

  • Route1
    • null|null
      80313-75-3
    • ~99%
    • Benzyl hexanoate|CS-0454959
      6938-45-0

    References

    • Mori, Akinori; Mizusaki, Tomoteru; Miyakawa, Yumi; Ohashi, Eri; Haga, Tomoko; Maegawa, Tomohiro; Monguchi, Yasunari; Sajiki, Hironao Tetrahedron, 2006 , vol. 62, # 51 p. 11925 - 11932
  • Route2

    References

    • Isobe, Toshio; Ishikawa, Tsutomu Journal of Organic Chemistry, 1999 , vol. 64, # 19 p. 6984 - 6988
  • Route3

    References

    • Maki, Brooks E.; Chan, Audrey; Scheidt, Karl A. Synthesis, 2008 , # 8 p. 1306 - 1315

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   3.3101
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   6

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