Acetic acid, (4-acetylphenoxy)-, ethyl ester


Chemical Name: Acetic acid, (4-acetylphenoxy)-, ethyl ester
CAS Number: 51828-69-4
Product Number: AG00I99U(AGN-PC-0JNH0C)
Synonyms:
MDL No:
Molecular Formula: C12H14O4
Molecular Weight: 222.2372

Identification/Properties


Computed Properties
Molecular Weight:
222.24g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
6
Exact Mass:
222.089g/mol
Monoisotopic Mass:
222.089g/mol
Topological Polar Surface Area:
52.6A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
241
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



Ethyl 2-(4-acetylphenoxy)acetate is an important compound used in chemical synthesis for various applications. It serves as a versatile building block in organic chemistry, enabling the synthesis of a wide range of complex molecules. Due to its unique structure and reactivity, this compound plays a crucial role in the development of pharmaceuticals, agrochemicals, and fine chemicals. Additionally, Ethyl 2-(4-acetylphenoxy)acetate can be utilized as a key intermediate in the preparation of various fragrances, flavors, and polymers. Its ability to undergo different chemical transformations makes it an essential component in the creation of new materials with tailored properties. In summary, Ethyl 2-(4-acetylphenoxy)acetate is a valuable tool for chemists engaged in the synthesis of diverse compounds with important industrial applications.