2-ethyloxan-4-one


Chemical Name: 2-ethyloxan-4-one
CAS Number: 36233-82-6
Product Number: AG00D2LJ(AGN-PC-03OYEN)
Synonyms:
MDL No:
Molecular Formula: C7H12O2
Molecular Weight: 128.1690

Identification/Properties


Computed Properties
Molecular Weight:
128.171g/mol
XLogP3:
0.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
128.084g/mol
Monoisotopic Mass:
128.084g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
110
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



2-Ethyloxan-4-one, also known as ethyl 2-oxacyclopentan-4-one, is a versatile compound commonly used in chemical synthesis. This organic compound plays a crucial role as a building block in the creation of various pharmaceuticals, agrochemicals, and specialty chemicals. In chemical synthesis, 2-Ethyloxan-4-one serves as a key intermediate in the production of a wide range of organic compounds. Its unique structure and reactivity allow for the incorporation of different functional groups, making it a valuable tool for organic chemists. One common application of 2-Ethyloxan-4-one is in the synthesis of heterocyclic compounds. By reacting with different reagents and catalysts, this compound can undergo various transformations to form complex rings and structures found in many biologically active compounds. Furthermore, 2-Ethyloxan-4-one can also be utilized in the preparation of chiral building blocks. Its chiral nature enables selective reactions to occur, leading to the formation of enantioenriched compounds with high optical purity. This is particularly important in the pharmaceutical industry where chirality plays a critical role in drug design and efficacy.Overall, 2-Ethyloxan-4-one is a valuable component in chemical synthesis, offering a wide range of applications in the creation of diverse organic molecules with potential applications in pharmaceuticals, agrochemicals, and specialty chemicals.