1-Propanone, 1-(methylphenyl)-


Chemical Name: 1-Propanone, 1-(methylphenyl)-
CAS Number: 2040-14-4
Product Number: AG00298G(AGN-PC-0JNYUO)
Synonyms:
MDL No:
Molecular Formula: C10H12O
Molecular Weight: 148.2017

Identification/Properties


Computed Properties
Molecular Weight:
148.205g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
2
Exact Mass:
148.089g/mol
Monoisotopic Mass:
148.089g/mol
Topological Polar Surface Area:
17.1A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
140
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

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NMR Spectrum


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Chemical Structure



1-(2-Methylphenyl)-1-propanone is a versatile compound used in various chemical synthesis processes. Commonly known as alpha-isopropylphenylacetone, this compound plays a crucial role as an intermediate in the synthesis of numerous organic compounds. Its application in chemical synthesis is wide-ranging and significant due to its unique chemical properties.In organic chemistry, 1-(2-Methylphenyl)-1-propanone serves as a key building block for the preparation of complex molecules. It is often used as a precursor in the synthesis of pharmaceuticals, agrochemicals, and fragrances. The structural characteristics of this compound make it a valuable reagent in the creation of diverse chemical structures.One of the primary applications of 1-(2-Methylphenyl)-1-propanone is in the synthesis of substituted amphetamines and related compounds. By undergoing various chemical reactions, such as reduction or oxidation processes, this compound can be transformed into intermediates that are essential for the production of psychoactive substances and pharmaceutical drugs.Moreover, 1-(2-Methylphenyl)-1-propanone is employed in the manufacturing of flavoring agents and aroma chemicals. Its incorporation into fragrance compositions contributes to the development of unique and appealing scents used in perfumes, cosmetics, and household products.Overall, the significance of 1-(2-Methylphenyl)-1-propanone in chemical synthesis lies in its role as a versatile building block for creating diverse organic compounds with numerous industrial applications.