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Hexyl 2-thiocyanatoacetate

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Identification
Molecular formula
C9H15NO2S
CAS number
85073-27-2
IUPAC name
hexyl 2-thiocyanatoacetate
State
State

Hexyl 2-thiocyanatoacetate is a liquid at room temperature. It remains in liquid form down to its freezing point of -32°C, making it suitable for applications in various temperature environments.

Melting point (Celsius)
-32.00
Melting point (Kelvin)
241.15
Boiling point (Celsius)
258.00
Boiling point (Kelvin)
531.15
General information
Molecular weight
245.34g/mol
Molar mass
245.3390g/mol
Density
1.0086g/cm3
Appearence

Hexyl 2-thiocyanatoacetate appears as a clear, colorless liquid with a faint characteristic odor. Its clarity and lack of color are typical for many lower-chain esters and hydrophobic organic compounds.

Comment on solubility

Solubility of Hexyl 2-thiocyanatoacetate

Hexyl 2-thiocyanatoacetate (C9H15NO2S) is an intriguing compound with unique characteristics related to its solubility. Understanding its solubility can provide insights into its potential applications and behavior in different environments.

Key Factors Affecting Solubility

The solubility of this compound can be influenced by various factors, including:

  • Polarity: The presence of the thiocyanate group contributes to the overall polarity of the molecule, potentially increasing solubility in polar solvents.
  • Chain Length: The hexyl group, being a long hydrophobic carbon chain, may create a challenge for solubility in water but enhances solubility in organic solvents.
  • Temperature: As with many organic compounds, increased temperature typically enhances solubility, making it crucial to consider when dissolving this compound.

Solvent Compatibility

Hexyl 2-thiocyanatoacetate is expected to exhibit varying solubility in different solvents. It is often:

  • Soluble in organic solvents such as ethanol, dichloromethane, and acetone.
  • Low solubility in water due to the hydrophobic nature of the hexyl group.

In summary, the solubility of hexyl 2-thiocyanatoacetate is a balanced interplay between its polar and non-polar components. This complexity makes it an interesting subject for further study in chemical and environmental contexts.

Interesting facts

Interesting Facts about Hexyl 2-thiocyanatoacetate

Hexyl 2-thiocyanatoacetate, also known as a thiocyanate ester, is a fascinating compound with various applications in organic chemistry and industries. Here are some key points that showcase its significance:

  • Thiocyanate Functionality: The presence of the thiocyanate group (–SCN) in hexyl 2-thiocyanatoacetate grants it unique properties, making it essential in the synthesis of other organic compounds.
  • Flavor and Fragrance: Compounds like thiocyanate esters are often investigated for their potential use in flavoring agents and fragrances, adding an interesting dimension to their application in the culinary and cosmetic industries.
  • Biological Activity: Research has suggested that thiocyanates can possess biological activity. This aspect opens up avenues for pharmacological studies, with potential implications in drug development.
  • Versatile Reactivity: Hexyl 2-thiocyanatoacetate can serve as a versatile building block in various organic reactions, facilitating the design of more complex chemical entities.
  • Environmental Consideration: Understanding compounds like hexyl 2-thiocyanatoacetate also plays a role in assessing environmental impact, particularly as thiocyanates can be concerning pollutants in aquatic systems when synthesized or used in excess.

As stated in organic chemistry literature, “Functional groups define a compound’s reactivity and interaction,” making the study of hexyl 2-thiocyanatoacetate not only intriguing but also essential for advancements in synthetic methods and materials.

With ongoing research, the full scope of its applications and impacts continues to unravel, showcasing the endless possibilities within the realm of organic chemistry.

Synonyms
hexyl 2-thiocyanatoacetate
13287-48-4
ACETIC ACID, THIOCYANATO-, HEXYL ESTER
Thiocyanatoacetic acid hexyl ester
Thiocyano-essigsaeure-n-hexyl-ester
BRN 1778284
Thiocyano-essigsaeure-n-hexyl-ester [German]
n- Hexyl-thiocyano-acetat
3-03-00-00431 (Beilstein Handbook Reference)
DTXSID20157823