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Hex-3-enyl benzoate

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Identification
Molecular formula
C13H16O2
CAS number
67634-00-8
IUPAC name
hex-3-enyl benzoate
State
State

At room temperature, hex-3-enyl benzoate is a liquid. It is not very volatile and has moderate viscosity, typical of many organic esters used in fragrance applications.

Melting point (Celsius)
-20.00
Melting point (Kelvin)
253.00
Boiling point (Celsius)
274.00
Boiling point (Kelvin)
547.00
General information
Molecular weight
216.29g/mol
Molar mass
216.2850g/mol
Density
1.0190g/cm3
Appearence

Hex-3-enyl benzoate is a clear, colorless liquid. It typically lacks any solid particles or impurities visible to the naked eye. This ester imparts a pleasant floral and slightly fruity aroma, making it of interest in the fragrance industry.

Comment on solubility

Solubility of Hex-3-enyl Benzoate

Hex-3-enyl benzoate, a compound characterized by the presence of both an alkene and an ester functional group, presents interesting solubility properties. Generally, the solubility of such esters can be affected by various factors, including:

  • Molecular Structure: The greater the hydrophobic hydrocarbon chain, the lower the solubility in water.
  • Polarity: Due to the presence of the ester group, hex-3-enyl benzoate is likely soluble in organic solvents.
  • Temperature: Solubility can increase with temperature in many organic solvents.

In practice, hex-3-enyl benzoate is expected to be insoluble or poorly soluble in water but soluble in non-polar and slightly polar organic solvents such as:

  • Slightly polar solvents like ethanol
  • Non-polar solvents such as hexane or benzene

As with many esters, it is crucial to note that “like dissolves like.” Therefore, hex-3-enyl benzoate's solubility profile aligns with the common behavior of organic esters, making it versatile for various applications in organic synthesis and material sciences.

Interesting facts

Hex-3-enyl Benzoate

Hex-3-enyl benzoate is an intriguing compound that belongs to the larger family of benzoate esters. This compound is notable for its dual functional groups: the benzoate moiety, which contributes aromatic characteristics, and the hex-3-enyl chain, known for its unsaturation and potential reactivity. Here are some interesting facts about hex-3-enyl benzoate:

  • Nature of Esters: Hex-3-enyl benzoate is an ester formed through the reaction of hex-3-enol and benzoic acid. Esters are well-known for their pleasant, fruity odors, making them popular in the fragrance and flavor industries.
  • Applications: This compound can be used in various applications, including:
    • As a potential ingredient in perfumes and cosmetics due to its aromatic profile.
    • In the food industry, where it could be utilized as a flavoring agent.
  • Reactivity: The presence of a double bond in the hex-3-enyl group allows for a variety of chemical reactions, such as
    • Addition reactions with electrophiles.
    • Polymerization processes, providing avenues for creating novel materials.
  • Biological Interest: Compounds similar to hex-3-enyl benzoate may exhibit biological activity, making them subjects of interest in medicinal chemistry. They have potential applications in drug development.
  • Environmental Considerations: As with many esters, understanding the environmental impact and degradation pathways of hex-3-enyl benzoate is essential for sustainable use.

In summary, hex-3-enyl benzoate encapsulates a wide range of chemical properties and applications. Its unique combination of aromatic and unsaturated features positions it as a captivating subject for further research and industrial utilization. As scientists continue to discover its various uses, this compound exemplifies the rich complexity of organic chemistry.

Synonyms
hex-3-en-1-yl benzoate
DTXSID8047555
72200-74-9
RefChem:347347
Hex-3-en-1-yl benzoic acid
3-Hexen-1-ol,1-benzoic acid
DTXCID6027555
SCHEMBL130435
benzoic acid hex-3-enyl ester
cis-3-Hexenyl benzoate, misture of isomers
NS00091039