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Home Fluorides 130047-19-7
130047-19-7,MFCD00061290
Catalog No.:AA000TUQ

130047-19-7 | 4-Fluoro-2-(trifluoromethyl)phenol

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
97%
in stock  
$6.00   $4.00
- +
1g
97%
in stock  
$8.00   $6.00
- +
5g
97%
in stock  
$21.00   $15.00
- +
10g
97%
in stock  
$38.00   $27.00
- +
25g
97%
in stock  
$82.00   $57.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA000TUQ
Chemical Name:
4-Fluoro-2-(trifluoromethyl)phenol
CAS Number:
130047-19-7
Molecular Formula:
C7H4F4O
Molecular Weight:
180.0997
MDL Number:
MFCD00061290
SMILES:
Fc1ccc(c(c1)C(F)(F)F)O
Properties
Properties
 
BP:
169.3°C at 760 mmHg  
Form:
Solid  
MP:
50-54℃  
Storage:
Inert atmosphere;2-8℃;  

Computed Properties
 
Complexity:
156  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
XLogP3:
2.6  

Downstream Synthesis Route

[1]CurrentPatentAssignee:ABBVIEINC-WO2017/89458,2017,A1Locationinpatent:Page/Pagecolumn81

[2]CurrentPatentAssignee:BAYERAG-US5130119,1992,A

[1]Locationinpatent:experimentalpartZhou,Xinming;He,Yantao;Wang,Miao;Ding,Yixiang[Phosphorus,SulfurandSiliconandtheRelatedElements,2009,vol.184,#3,p.651-659]

[1]Locationinpatent:experimentalpartZhou,Xinming;He,Yantao;Wang,Miao;Ding,Yixiang[Phosphorus,SulfurandSiliconandtheRelatedElements,2009,vol.184,#3,p.651-659]

[1]CurrentPatentAssignee:PFIZERINC-US2012/252758,2012,A1Locationinpatent:Page/Pagecolumn33

[2]Pettersson,Martin;Johnson,DouglasS.;Subramanyam,Chakrapani;Bales,KellyR.;AmEnde,ChristopherW.;Fish,BenjaminA.;Green,MichaelE.;Kauffman,GregoryW.;Mullins,PatrickB.;Navaratnam,Thayalan;Sakya,SubasM.;Stiff,CoryM.;Tran,TuanP.;Xie,Longfei;Zhang,Liming;Pustilnik,LeslieR.;Vetelino,BethC.;Wood,KathleenM.;Pozdnyakov,Nikolay;Verhoest,PatrickR.;O'Donnell,ChristopherJ.[JournalofMedicinalChemistry,2014,vol.57,#3,p.1046-1062]

79069-13-9   
4-fluoro-2-(trifluoromethyl)phenol 
  1402003-88-6 

[1]CurrentPatentAssignee:PFIZERINC-US2012/252758,2012,A1Locationinpatent:Page/Pagecolumn21

Literature
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SDS
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