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Home Fluorides 42580-42-7
42580-42-7,MFCD00013249
Catalog No.:AA003FTG

42580-42-7 | 2,5-Bis(trifluoromethyl)benzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$37.00   $26.00
- +
5g
95%
in stock  
$79.00   $55.00
- +
10g
95%
in stock  
$125.00   $88.00
- +
25g
98%
in stock  
$190.00   $133.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003FTG
Chemical Name:
2,5-Bis(trifluoromethyl)benzoic acid
CAS Number:
42580-42-7
Molecular Formula:
C9H4F6O2
Molecular Weight:
258.1173
MDL Number:
MFCD00013249
SMILES:
OC(=O)c1cc(ccc1C(F)(F)F)C(F)(F)F
Properties
Properties
 
BP:
248.5°C at 760 mmHg  
Form:
Solid  
MP:
78-80 °C(lit.)  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
295  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
3.2  

Downstream Synthesis Route

[1]Chemistry-AEuropeanJournal,1998,vol.4,p.1281-1286

[1]Patent:US5965744,1999,A

42580-42-7   
dibenzyl(5-aminopentane-1,4-diyl)-(S)-dicarbamate 
 
dibenzyl(5-aminopentane-1,4-diyl)(S)-dicarbamatedihydrochloride 

[1]Patent:US2016/271082,2016,A1.Locationinpatent:Paragraph0157

Literature
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Additional Info:
SDS
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Tags:42580-42-7 Molecular Formula|42580-42-7 MDL|42580-42-7 SMILES|42580-42-7 2,5-Bis(trifluoromethyl)benzoic acid |Organic_Building_Blocks