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111771-08-5,MFCD00042289
Catalog No.:AA003H84

111771-08-5 | 2-Fluoro-6-iodobenzoic acid

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1g
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$16.00   $11.00
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5g
98%
in stock  
$22.00   $15.00
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10g
98%
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$26.00   $18.00
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25g
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100g
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  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003H84
Chemical Name:
2-Fluoro-6-iodobenzoic acid
CAS Number:
111771-08-5
Molecular Formula:
C7H4FIO2
Molecular Weight:
266.0083
MDL Number:
MFCD00042289
SMILES:
OC(=O)c1c(F)cccc1I
Properties
Properties
 
Form:
Solid  
MP:
123-126 °C(lit.)  
Stability:
Light Sensitive  
Storage:
2-8℃;  

Computed Properties
 
Complexity:
163  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
2.2  

Upstream Synthesis Route

[1]Synthesis,2005,#4,p.617-621

[1]EuropeanJournalofOrganicChemistry,2002,#19,p.3351-3358

[2]Synthesis,2005,#4,p.617-621

[3]Patent:WO2008/103615,2008,A1,.Locationinpatent:Page/Pagecolumn41

[1]AngewandteChemie-InternationalEdition,2008,vol.47,#28,p.5215-5219

[2]ACSCatalysis,2018,vol.8,#2,p.920-925

[1]Synthesis,2005,#4,p.617-621

[1]Synthesis,2005,#4,p.617-621

Downstream Synthesis Route

[1]JournalofOrganicChemistry,1988,vol.53,p.345-352

[2]JournalofMedicinalChemistry,2007,vol.50,p.272-282

[3]JournalofMedicinalChemistry,2009,vol.52,p.3047-3062

[4]Patent:WO2011/50200,2011,A1.Locationinpatent:Page/Pagecolumn87

[5]Patent:WO2011/50202,2011,A1.Locationinpatent:Page/Pagecolumn59

[6]Patent:WO2013/92893,2013,A1.Locationinpatent:Page/Pagecolumn44;45

[7]Patent:US2014/357653,2014,A1.Locationinpatent:Paragraph0280;0281;0282;0283;0284;0285

[8]OrganicLetters,2019,vol.21,p.9960-9964

[9]JournalofMedicinalChemistry,2019,vol.62,p.10221-10244

[1]JournalofMedicinalChemistry,2007,vol.50,p.272-282

111771-08-5    75-03-6   
ethyl2-fluoro-6-iodobenzoate 

[1]JournalofMedicinalChemistry,2007,vol.50,p.272-282

[1]JournalofMedicinalChemistry,2007,vol.50,p.272-282

[1]JournalofMedicinalChemistry,2007,vol.50,p.272-282

Literature

Title: New substituted isocoumarins and Dihydroisocoumarins and their cytotoxic activities.

Journal: Scientia pharmaceutica 20110101

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SDS
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