3-Pyridinecarboxylic acid, 2-[[2-methyl-3-(trifluoromethyl)phenyl]amino]-


Chemical Name: 3-Pyridinecarboxylic acid, 2-[[2-methyl-3-(trifluoromethyl)phenyl]amino]-
CAS Number: 38677-85-9
Product Number: AG0078MC(AGN-PC-00UN4D)
Synonyms:
MDL No:
Molecular Formula: C14H11F3N2O2
Molecular Weight: 296.2445

Identification/Properties


Computed Properties
Molecular Weight:
296.249g/mol
XLogP3:
4.1
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
3
Exact Mass:
296.077g/mol
Monoisotopic Mass:
296.077g/mol
Topological Polar Surface Area:
62.2A^2
Heavy Atom Count:
21
Formal Charge:
0
Complexity:
376
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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