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1-methylhexyl hexanoate

  • CAS No.: 6624-58-4
  • Purity: 99%
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  • Molecular Formula: C13H26 O2
  • Molecular Weight: 214.348
  • Vapor Pressure: 2.61E-10mmHg at 25°C 
  • Boiling Point: 504.6°C at 760 mmHg 
  • Flash Point: 209.4°C 
  • PSA: 26.30000 
  • Density: 1.46g/cm3 
  • LogP: 4.07870 

1-methylhexyl hexanoate(Cas 6624-58-4) Usage

Properties & Specific Content of 1-Methylhexyl Hexanoate

A compound consisting of 12 carbon atoms, 24 hydrogen atoms, and 2 oxygen atoms.

Type of Compound

Ester (Hexanoate Ester)
A chemical compound formed by the reaction of an acid (hexanoic acid) and an alcohol (1-methylhexanol).

Usage in Fragrances

Common
Widely used as a fragrance ingredient in perfumes and cosmetic products.

Odor Description

Fruity, Green, Apple-Like
A pleasant aroma that resembles the scent of fresh apples with a hint of green and fruity notes.

Aroma Characteristics

Fresh, Crisp, and Sweet
Imparts a clean, invigorating, and slightly sweet scent to various consumer products.

Alternative Uses

Flavoring Agent & Solvent
Employed as a flavoring agent in food products and as a solvent in various industrial applications.

Safety Considerations

Safe when regulated
Considered safe for use in consumer products when used in accordance with industry regulations and guidelines.

General Description

1-methylhexyl hexanoate is a chemical compound with the molecular formula C12H24O2. It is an ester, specifically a hexanoate ester, which is commonly used as a fragrance ingredient in perfumes and cosmetic products. 1-methylhexyl hexanoate has a fruity, green, apple-like odor and is often used to impart a fresh, crisp, and sweet aroma to various consumer products. In addition to its use in the fragrance industry, 1-methylhexyl hexanoate can also be used as a flavoring agent in food products and as a solvent in various industrial applications. It is considered to be safe for use in consumer products when used in accordance with industry regulations and guidelines.

InChI:InChI=1/C17H11Cl2FO3/c1-9-12-6-13(18)15(7-14(12)23-17(21)16(9)19)22-8-10-2-4-11(20)5-3-10/h2-7H,8H2,1H3

6624-58-4 Relevant articles

Enantioselective analysis of secondary alcohols and their esters in purple and yellow passion fruits

Strohalm, Hedwig,Dregus, Marta,Wahl, Astrid,Engel, Karl-Heinz

experimental part, p. 10339 - 10344 (2009/09/25)

The enantiomeric compositions of the ace...

6624-58-4 Process route

2-Heptanol
52390-72-4,543-49-7

2-Heptanol

Hexanoyl chloride
142-61-0

Hexanoyl chloride

2-heptyl hexanoate
6624-58-4

2-heptyl hexanoate

Conditions
Conditions Yield
With pyridine;
2-Heptanol; Hexanoyl chloride; With pyridine; dmap; at 20 ℃;
Cooling with ice;

6624-58-4 Upstream products

  • 52390-72-4
    52390-72-4

    2-Heptanol

  • 142-61-0
    142-61-0

    Hexanoyl chloride

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