2-Propen-1-one, 3-(dimethylamino)-1-(3-pyridinyl)-, (E)-


Chemical Name: 2-Propen-1-one, 3-(dimethylamino)-1-(3-pyridinyl)-, (E)-
CAS Number: 123367-26-0
Product Number: AG000KGF(AGN-PC-0O0MIF)
Synonyms:
MDL No:
Molecular Formula: C10H12N2O
Molecular Weight: 176.2151

Identification/Properties


Computed Properties
Molecular Weight:
176.219g/mol
XLogP3:
0.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
176.095g/mol
Monoisotopic Mass:
176.095g/mol
Topological Polar Surface Area:
33.2A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
199
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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Chemical Structure



The compound (E)-3-(Dimethylamino)-1-(pyridin-3-yl)prop-2-en-1-one is a versatile building block in chemical synthesis due to its unique structure and reactivity. It is commonly utilized as a key intermediate in the production of various pharmaceuticals and organic compounds. In synthetic organic chemistry, this compound serves as a valuable starting material for the preparation of heterocyclic compounds, such as pyridine derivatives and other complex structures. Its ability to undergo diverse chemical transformations, including condensation reactions, nucleophilic additions, and cyclizations, makes it a valuable tool for the creation of novel molecules with potential biological activities. Additionally, (E)-3-(Dimethylamino)-1-(pyridin-3-yl)prop-2-en-1-one can be employed in the synthesis of ligands, dyes, and other fine chemicals, highlighting its importance in the field of chemical synthesis.