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716362-12-8,MFCD28650915
Catalog No.:AA01A4IV

716362-12-8 | 4-(Trifluoromethyl)-1H-pyrazole-3-carboxylic acid

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Purity
Availability
Price(USD)
Quantity
  
1g
96%
in stock  
$947.00   $663.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA01A4IV
Chemical Name:
4-(Trifluoromethyl)-1H-pyrazole-3-carboxylic acid
CAS Number:
716362-12-8
Molecular Formula:
C5H3F3N2O2
Molecular Weight:
180.0847
MDL Number:
MFCD28650915
SMILES:
OC(=O)c1n[nH]cc1C(F)(F)F
Properties
Computed Properties
 
Complexity:
194  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
1  
XLogP3:
1  

Downstream Synthesis Route

[1]Janin,YvesL.[JournalofHeterocyclicChemistry,2013,vol.50,#6,p.1410-1414]

Literature
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SDS
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Tags:716362-12-8 Molecular Formula|716362-12-8 MDL|716362-12-8 SMILES|716362-12-8 4-(Trifluoromethyl)-1H-pyrazole-3-carboxylic acid