1119-44-4 | 3-Hepten-2-one

Packsize	Purity	Availability	Price	Discounted Price
1g	95%	in stock	$25.00	$17.00
5g	95%	in stock	$34.00	$24.00
25g	95%	in stock	$87.00	$61.00
100g	95%	in stock	$318.00	$223.00

Description

• Catalog Number: AB65056
• Chemical Name: 3-Hepten-2-one
• CAS Number: 1119-44-4
• Molecular Formula: C7H12O
• Molecular Weight: 112.16958
• MDL Number: MFCD00015564
• SMILES: CCCC=CC(=O)C

Computed Properties

• Complexity: 92.6
• Covalently-Bonded Unit Count: 1
• Defined Bond Stereocenter Count: 1
• Heavy Atom Count: 8
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• XLogP3: 1.7

Upstream Synthesis Route

3-Hepten-2-one, also known as methyl heptenone, is a versatile compound commonly used in chemical synthesis for its unique properties and diverse applications. This unsaturated ketone is valued for its role as a building block in the production of various chemicals and materials. In chemical synthesis, 3-Hepten-2-one serves as a key intermediate in the preparation of fragrances, flavors, pharmaceuticals, and other fine chemicals. Additionally, its reactivity and structure make it a valuable starting material for the synthesis of different organic compounds through various chemical reactions, including oxidation, reduction, and functional group transformations. The presence of the unsaturated double bond in 3-Hepten-2-one also lends itself to participating in diverse organic transformations, allowing for the creation of complex molecular structures. Its applications extend to the flavor and fragrance industry where it is used to impart pleasant and distinctive scents in perfumes, cosmetics, and food products. Furthermore, 3-Hepten-2-one finds utility in medicinal chemistry as a precursor in the synthesis of pharmaceutical compounds with therapeutic properties. In summary, the significant role of 3-Hepten-2-one in chemical synthesis lies in its versatility as a building block that enables the creation of a wide range of valuable compounds across different industries.