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CS-W001157 4
Total: USD 88.00

1-(2,2-Diethoxyethoxy)-4-fluorobenzene

  • CAS No. 59769-37-8

  • Cat. No. CS-0363318
  • Purity≥98%
  • MDL No.None

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

1-(2,2-Diethoxyethoxy)-4-fluorobenzene|CS-0363318

Structure of 59769-37-8

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General Information

  • CAS No. 59769-37-8
  • Cat. No. CS-0363318
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₇FO₃
  • Molecular Weight 228.26
  • Synonym(s) 1-(2,2-Diethoxy-ethoxy)-4-fluoro-benzene
  • SMILES CCOC(COC1=CC=C(C=C1)F)OCC

Synthesis

  • Route1

    References

    • BIOENERGENIX; MCCALL, John M.; ROMERO, Donna L.; KELLY, Robert C. Patent: WO2012/119046 A2, 2012 ; Location in patent: Page/Page column 65 ;
  • Route2

    References

    • Merck and Co., Inc. Patent: US4059587 A1, 1977 ;
  • Route3

    References

    • Lipinski, C. A.; Stam, J. G.; Pereira, J. N.; Ackerman, N. R.; Hess, H.-J. Journal of Medicinal Chemistry, 1980 , vol. 23, # 9 p. 1026 - 1031

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   27.69
  • LogP   2.6036
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   7

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