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Home Fluorides 365425-94-1
365425-94-1,MFCD07850267
Catalog No.:AA00CLL8

365425-94-1 | N-(2,2,2-Trifluoroethyl) 4-nitrobenzamide

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$261.00   $183.00
- +
5g
98%
in stock  
$909.00   $637.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00CLL8
Chemical Name:
N-(2,2,2-Trifluoroethyl) 4-nitrobenzamide
CAS Number:
365425-94-1
Molecular Formula:
C9H7F3N2O3
Molecular Weight:
248.1587
MDL Number:
MFCD07850267
SMILES:
O=C(c1ccc(cc1)[N+](=O)[O-])NCC(F)(F)F
Properties
Properties
 
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
293  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
2.1  

Downstream Synthesis Route

[1]Hegarty,AnthonyF.;Eustace,StephenJ.;Tynan,NualaM.;Pham-Tran,Nguyen-Nguyen;Nguyen,MinhTho[JournaloftheChemicalSociety.PerkinTransactions2(2001),2001,#7,p.1239-1246]

[2]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-WO2007/42298,2007,A1Locationinpatent:Page/Pagecolumn88

[1]Hegarty,AnthonyF.;Eustace,StephenJ.;Tynan,NualaM.;Pham-Tran,Nguyen-Nguyen;Nguyen,MinhTho[JournaloftheChemicalSociety.PerkinTransactions2(2001),2001,#7,p.1239-1246]

[1]Um,Ik-Hwan;Kim,Kyung-Hee;Park,Hye-Ran;Fujio,Mizue;Tsuno,Yuho[JournalofOrganicChemistry,2004,vol.69,#11,p.3937-3942]

[1]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-WO2007/42298,2007,A1Locationinpatent:Page/Pagecolumn87-88

Literature
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SDS
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Tags:365425-94-1 Molecular Formula|365425-94-1 MDL|365425-94-1 SMILES|365425-94-1 N-(2,2,2-Trifluoroethyl) 4-nitrobenzamide