4-hydroxy-6-(trifluoromethyl)-1H-pyridin-2-one


Chemical Name: 4-hydroxy-6-(trifluoromethyl)-1H-pyridin-2-one
CAS Number: 947144-32-3
Product Number: AG00697N(AGN-PC-0HG2O3)
Synonyms:
MDL No:
Molecular Formula: C6H4F3NO2
Molecular Weight: 179.0967

Identification/Properties


Properties
Storage:
Keep in dry area;2-8℃;
Computed Properties
Molecular Weight:
179.098g/mol
XLogP3:
0.5
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
0
Exact Mass:
179.019g/mol
Monoisotopic Mass:
179.019g/mol
Topological Polar Surface Area:
49.3A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
277
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

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



4-Hydroxy-6-(trifluoromethyl)pyridin-2(1H)-one is a versatile compound commonly used in chemical synthesis for its unique properties. Its trifluoromethyl group provides enhanced reactivity and stability, making it a valuable building block in the synthesis of various organic compounds. This compound is particularly useful in the preparation of pharmaceuticals, agrochemicals, and specialty chemicals due to its ability to introduce fluorinated motifs into the molecular structures of target compounds. Additionally, 4-Hydroxy-6-(trifluoromethyl)pyridin-2(1H)-one can serve as a key intermediate in the synthesis of complex molecules with diverse applications in the fields of medicinal chemistry and material science.