Home Fluorides 1027513-14-9
1027513-14-9,MFCD09800718
Catalog No.:AA00087B

1027513-14-9 | 3-Fluoro-5-iodobenzotrifluoride

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100mg
95%
in stock  
$69.00   $48.00
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250mg
95%
in stock  
$128.00   $90.00
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5g
95%
in stock  
$2,336.00   $1,635.00
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  • Technical Information
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  • Downstream Synthesis Route
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00087B
Chemical Name:
3-Fluoro-5-iodobenzotrifluoride
CAS Number:
1027513-14-9
Molecular Formula:
C7H3F4I
Molecular Weight:
289.9968
MDL Number:
MFCD09800718
SMILES:
Fc1cc(I)cc(c1)C(F)(F)F
Properties
Computed Properties
 
Complexity:
156  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
XLogP3:
3.6  

Downstream Synthesis Route

[1]OrganicandBiomolecularChemistry,2009,vol.7,p.1627-1632

[1]OrganicandBiomolecularChemistry,2009,vol.7,p.1627-1632

1027513-14-9   
tert-butyl(Z)-(2-(4-(1-(3-fluoro-1-(tetrahydro-2H-pyran-2-yl)-1H-indazol-5-yl)-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)but-1-en-1-yl)phenoxy)ethyl)carbamate 
 
tert-butyl(E)-(2-(4-(1-(3-fluoro-1-(tetrahydro-2H-pyran-2-yl)-1H-indazol-5-yl)-2-(3-fluoro-5-(trifluoromethyl)phenyl)but-1-en-1-yl)phenoxy)ethyl)carbamate 

[1]Patent:US2016/347717,2016,A1.Locationinpatent:Paragraph0283;0284

Literature
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Tags:1027513-14-9 Molecular Formula|1027513-14-9 MDL|1027513-14-9 SMILES|1027513-14-9 3-Fluoro-5-iodobenzotrifluoride