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Home Other Building Blocks 4-(Trifluoromethyl)nicotinamide

4-(Trifluoromethyl)nicotinamide

CAS No.:
158062-71-6
Catalog Number:
AG001PXW
Molecular Formula:
C7H5F3N2O
Molecular Weight:
190.1226
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
1 week
United States
$44
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Product Description
Catalog Number:
AG001PXW
Chemical Name:
4-(Trifluoromethyl)nicotinamide
CAS Number:
158062-71-6
Molecular Formula:
C7H5F3N2O
Molecular Weight:
190.1226
MDL Number:
MFCD00126658
IUPAC Name:
4-(trifluoromethyl)pyridine-3-carboxamide
InChI:
InChI=1S/C7H5F3N2O/c8-7(9,10)5-1-2-12-3-4(5)6(11)13/h1-3H,(H2,11,13)
InChI Key:
JUIWZYBJXUPIKF-UHFFFAOYSA-N
SMILES:
NC(=O)c1cnccc1C(F)(F)F
UNII:
4346BHK4MJ
Properties
Complexity:
204  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.035g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
190.125g/mol
Monoisotopic Mass:
190.035g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
56A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Literature
Title Journal
[Simultaneous determination of flonicamid and its metabolites in cucumbers and apples by liquid chromatography-tandem mass spectrometry]. Se pu = Chinese journal of chromatography 20120601
Simultaneous determination of flonicamid and its metabolites in vegetables using QuEChERS and reverse-phase liquid chromatography-tandem mass spectrometry. Journal of chromatography. A 20110923
Analysis of flonicamid and its metabolites in dried hops by liquid chromatography-tandem mass spectrometry. Journal of agricultural and food chemistry 20071003
Properties