3,5-Heptanedione, 4-methyl-


Chemical Name: 3,5-Heptanedione, 4-methyl-
CAS Number: 1187-04-8
Product Number: AG00942I(AGN-PC-0KNUVM)
Synonyms:
MDL No:
Molecular Formula: C8H14O2
Molecular Weight: 142.1956

Identification/Properties


Computed Properties
Molecular Weight:
142.198g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
4
Exact Mass:
142.099g/mol
Monoisotopic Mass:
142.099g/mol
Topological Polar Surface Area:
34.1A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
122
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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Chemical Structure



4-Methylheptane-3,5-dione, also known as diacetylacetone, is a versatile chemical compound widely used in chemical synthesis processes. This compound plays a crucial role in various reactions and transformations due to its unique structure and reactivity.One of the key applications of 4-Methylheptane-3,5-dione in chemical synthesis is its use as a chelating agent. This compound has the ability to form stable complexes with metal ions by coordinating through its carbonyl groups. These chelate complexes are highly valuable in various industrial processes, such as in catalysis, metal ion detection, and metal extraction.Additionally, 4-Methylheptane-3,5-dione is utilized in the synthesis of organic compounds and pharmaceutical intermediates. Its carbonyl groups can undergo a variety of reactions, including condensation, nucleophilic addition, and oxidation, making it a versatile building block for creating a wide range of complex molecules.Furthermore, this compound is also employed as a ligand in coordination chemistry, where it can bind to metal ions and influence their reactivity and coordination geometry. In organometallic chemistry, 4-Methylheptane-3,5-dione is often used to stabilize metal complexes and enhance their catalytic properties.Overall, 4-Methylheptane-3,5-dione is a valuable compound in chemical synthesis, offering a range of applications in various fields of chemistry, including coordination chemistry, organic synthesis, and catalysis. Its versatility and reactivity make it an essential component in the toolbox of synthetic chemists and researchers.