Home Fluorides 115611-57-9
115611-57-9,MFCD16620487
Catalog No.:AA000G6N

115611-57-9 | 1,1,2,2-Tetrafluoroethyl benzyl ether

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Purity
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1g
95%
in stock  
$45.00   $32.00
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5g
95%
in stock  
$95.00   $67.00
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25g
95%
in stock  
$203.00   $142.00
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100g
95%
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$502.00   $352.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA000G6N
Chemical Name:
1,1,2,2-Tetrafluoroethyl benzyl ether
CAS Number:
115611-57-9
Molecular Formula:
C9H8F4O
Molecular Weight:
208.1528
MDL Number:
MFCD16620487
SMILES:
FC(C(OCc1ccccc1)(F)F)F
Properties
Computed Properties
 
Complexity:
166  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
1  
XLogP3:
3.2  

Downstream Synthesis Route

[1]Nguyen,Thoai[JournalofFluorineChemistry,1988,vol.38,p.95-106]

115611-57-9    2925-22-6   
benzyl2,2-difluoroacetate 

[1]Nguyen,Thoai[JournalofFluorineChemistry,1988,vol.38,p.95-106]

[1]Nguyen,Thoai[JournalofFluorineChemistry,1988,vol.38,p.95-106]

Literature

Title: Docking and molecular dynamics study on the inhibitory activity of N, N-disubstituted-trifluoro-3-amino-2-propanols-based inhibitors of cholesteryl ester transfer protein.

Journal: Journal of molecular modeling 20110701

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SDS
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Tags:115611-57-9 Molecular Formula|115611-57-9 MDL|115611-57-9 SMILES|115611-57-9 1,1,2,2-Tetrafluoroethyl benzyl ether