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Home Fluorides 57330-59-3
57330-59-3,MFCD17015785
Catalog No.:AA00EBKS

57330-59-3 | 1-(2-Nitro-4-trifluoromethoxyphenyl)propan-2-one

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$220.00   $154.00
- +
5g
98%
in stock  
$793.00   $555.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00EBKS
Chemical Name:
1-(2-Nitro-4-trifluoromethoxyphenyl)propan-2-one
CAS Number:
57330-59-3
Molecular Formula:
C10H8F3NO4
Molecular Weight:
263.1700
MDL Number:
MFCD17015785
SMILES:
CC(=O)Cc1ccc(cc1[N+](=O)[O-])OC(F)(F)F
Properties
Computed Properties
 
Complexity:
326  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
7  
Rotatable Bond Count:
3  
XLogP3:
2.6  

Downstream Synthesis Route

[1]OrganicProcessResearchandDevelopment,2009,vol.13,p.525-534

[2]Patent:WO2006/99077,2006,A1.Locationinpatent:Page/Pagecolumn8;22-23

[1]Locationinpatent:experimentalpartMaligres,PeterE.;Humphrey,GuyR.;Marcoux,Jean-Francois;Hillier,MichaelC.;Zhao,Dalian;Krska,Shane;Grabowski,EdwardJ.J.[OrganicProcessResearchandDevelopment,2009,vol.13,#3,p.525-534]

Literature
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SDS
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Tags:57330-59-3 Molecular Formula|57330-59-3 MDL|57330-59-3 SMILES|57330-59-3 1-(2-Nitro-4-trifluoromethoxyphenyl)propan-2-one