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Home Fluorides 655-00-5
655-00-5,MFCD18398158
Catalog No.:AA00EL3X

655-00-5 | 5-Iodo-2-(trifluoromethyl)benzoic acid

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Purity
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Quantity
  
1g
95%
in stock  
$225.00   $158.00
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  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Literature
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  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00EL3X
Chemical Name:
5-Iodo-2-(trifluoromethyl)benzoic acid
CAS Number:
655-00-5
Molecular Formula:
C8H4F3IO2
Molecular Weight:
316.0158
MDL Number:
MFCD18398158
SMILES:
C1=CC(=C(C=C1I)C(=O)O)C(F)(F)F
Properties
Computed Properties
 
Complexity:
229  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
3  

Upstream Synthesis Route

[1]ChemicalCommunications,2014,vol.50,#71,p.10237-10240

Literature
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SDS
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Tags:655-00-5 Molecular Formula|655-00-5 MDL|655-00-5 SMILES|655-00-5 5-Iodo-2-(trifluoromethyl)benzoic acid