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Home Fluorides 926222-59-5
926222-59-5,MFCD09042339
Catalog No.:AA00IH69

926222-59-5 | 2-Fluoro-4-(3-trifluoromethylphenyl)benzoic acid

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Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$211.00   $148.00
- +
5g
98%
in stock  
$610.00   $427.00
- +
10g
98%
in stock  
$976.00   $683.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00IH69
Chemical Name:
2-Fluoro-4-(3-trifluoromethylphenyl)benzoic acid
CAS Number:
926222-59-5
Molecular Formula:
C14H8F4O2
Molecular Weight:
284.2057
MDL Number:
MFCD09042339
SMILES:
OC(=O)c1ccc(cc1F)c1cccc(c1)C(F)(F)F
Properties
Computed Properties
 
Complexity:
356  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
4.1  

Downstream Synthesis Route

[1]Locationinpatent:experimentalpartShen,HongC.;Ding,Fa-Xiang;Deng,Qiaolin;Xu,Suoyu;Tong,Xinchun;Zhang,Xiaoping;Chen,Yuli;Zhou,Gaochao;Pai,Lee-Yuh;Alonso-Galicia,Magdalena;Roy,Sophie;Zhang,Bei;Tata,JamesR.;Berger,JoelP.;Colletti,StevenL.[BioorganicandMedicinalChemistryLetters,2009,vol.19,#19,p.5716-5721]

[1]Calvet,ClaudiaM.;Vieira,DeboraF.;Choi,JunYong;Kellar,Danielle;Cameron,MichaelD.;Siqueira-Neto,JairLage;Gut,Jiri;Johnston,JonathanB.;Lin,Li;Khan,Susan;McKerrow,JamesH.;Roush,WilliamR.;Podust,LarissaM.[JournalofMedicinalChemistry,2014,vol.57,#16,p.6989-7005]

[2]CurrentPatentAssignee:JOHNSON&JOHNSONINC-US2012/101081,2012,A1Locationinpatent:Page/Pagecolumn56;57

926222-59-5   
(R)-2-amino-3-(1H-indol-3-yl)-N-(pyridin-4-yl)propanamidehydrochloricacid 
 
(R)-N-(3-(1H-indol-3-yl)-1-oxo-1-(pyridin-4-ylamino)propan-2-yl)-3-fluoro-3'-(trifluoromethyl)-1,1'-biphenyl-4-carboxamidehydrochloride 

[1]Calvet,ClaudiaM.;Vieira,DeboraF.;Choi,JunYong;Kellar,Danielle;Cameron,MichaelD.;Siqueira-Neto,JairLage;Gut,Jiri;Johnston,JonathanB.;Lin,Li;Khan,Susan;McKerrow,JamesH.;Roush,WilliamR.;Podust,LarissaM.[JournalofMedicinalChemistry,2014,vol.57,#16,p.6989-7005]

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SDS
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Tags:926222-59-5 Molecular Formula|926222-59-5 MDL|926222-59-5 SMILES|926222-59-5 2-Fluoro-4-(3-trifluoromethylphenyl)benzoic acid