1-(6-ethoxypyridin-3-yl)ethanone


Chemical Name: 1-(6-ethoxypyridin-3-yl)ethanone
CAS Number: 885229-37-8
Product Number: AG00H1IC(AGN-PC-0A1YYJ)
Synonyms:
MDL No:
Molecular Formula: C9H11NO2
Molecular Weight: 165.1891

Identification/Properties


Computed Properties
Molecular Weight:
165.192g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
165.079g/mol
Monoisotopic Mass:
165.079g/mol
Topological Polar Surface Area:
39.2A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
159
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-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



1-(6-Ethoxypyridin-3-yl)ethanone is a versatile compound commonly used in chemical synthesis as a key building block. Its application in organic chemistry is particularly significant due to its ability to participate in a variety of reactions, leading to the synthesis of diverse compounds with unique properties.One of the main applications of 1-(6-Ethoxypyridin-3-yl)ethanone is in the formation of heterocyclic compounds. By reacting this compound with various reagents, chemists can access a wide range of heterocycles, which are essential structures found in many natural products and pharmaceuticals. These heterocyclic compounds exhibit interesting biological activities and are vital for drug discovery and development.Additionally, 1-(6-Ethoxypyridin-3-yl)ethanone can be utilized in the synthesis of chiral compounds. Through selective reactions and functional group modifications, this compound can be transformed into chiral building blocks, which are crucial for the production of enantiomerically pure pharmaceuticals and agrochemicals.Furthermore, the presence of the ethoxypyridine moiety in this compound can enable specific interactions in molecular recognition processes. This property can be exploited in the design and synthesis of ligands for catalysis, molecular sensors, and other applications where precise molecular recognition is required.Overall, the versatility of 1-(6-Ethoxypyridin-3-yl)ethanone in various chemical transformations makes it a valuable tool in the hands of synthetic chemists for the creation of complex organic molecules with diverse applications.