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Home Fluorides 290825-52-4
290825-52-4,MFCD03617804
Catalog No.:AA002X6Z

290825-52-4 | Dimethyl 2-(2-nitro-4-trifluoromethylphenyl)malonate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$62.00   $44.00
- +
5g
98%
in stock  
$162.00   $113.00
- +
10g
98%
in stock  
$278.00   $195.00
- +
25g
98%
in stock  
$544.00   $381.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA002X6Z
Chemical Name:
Dimethyl 2-(2-nitro-4-trifluoromethylphenyl)malonate
CAS Number:
290825-52-4
Molecular Formula:
C12H10F3NO6
Molecular Weight:
321.2061
MDL Number:
MFCD03617804
SMILES:
COC(=O)C(c1ccc(cc1[N+](=O)[O-])C(F)(F)F)C(=O)OC
Properties
Properties
 
BP:
361.3°C at 760 mmHg  
Form:
Solid  
MP:
57-58℃  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
431  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
9  
Rotatable Bond Count:
5  
XLogP3:
2.5  

Downstream Synthesis Route

[1]CurrentPatentAssignee:UNIVERSITYOFKANSAS-US2006/47126,2006,A1Locationinpatent:Page/Pagecolumn26

[2]CurrentPatentAssignee:PFIZERINC-US6350754,2002,B2Locationinpatent:Pagecolumn22

[3]CurrentPatentAssignee:UNIVERSITYOFKANSAS-WO2011/5759,2011,A2Locationinpatent:Page/Pagecolumn71

[4]CurrentPatentAssignee:PFIZERINC-US6878733,2005,B1Locationinpatent:Page/Pagecolumn171

[1]CurrentPatentAssignee:UNIVERSITYOFKANSAS-US2006/47126,2006,A1Locationinpatent:Page/Pagecolumn26

[2]CurrentPatentAssignee:UNIVERSITYOFKANSAS-WO2011/5759,2011,A2Locationinpatent:Page/Pagecolumn70-71

65754-26-9   
ammoniumchloride 
  95-92-1    290825-52-4 

[1]CurrentPatentAssignee:PFIZERINC-US6486185,2002,B1

[2]CurrentPatentAssignee:PFIZERINC-US2003/69421,2003,A1CurrentPatentAssignee:PFIZERINC-US6051593,2000,A

[3]CurrentPatentAssignee:PFIZERINC-US6114371,2000,A

[1]Patent:WO2007/106564,2007,A2.Locationinpatent:Page/Pagecolumn49-50

[1]CurrentPatentAssignee:LIGANDPHARMACEUTICALSINC-WO2007/106564,2007,A2Locationinpatent:Page/Pagecolumn49-50

Literature
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SDS
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Tags:290825-52-4 Molecular Formula|290825-52-4 MDL|290825-52-4 SMILES|290825-52-4 Dimethyl 2-(2-nitro-4-trifluoromethylphenyl)malonate