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Cyclohexyl 2-thiocyanatoacetate

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Identification
Molecular formula
C9H13NO2S
CAS number
6080-86-6
IUPAC name
cyclohexyl 2-thiocyanatoacetate
State
State

At room temperature, cyclohexyl 2-thiocyanatoacetate is predominantly in a liquid state. It is not typically volatile and remains stable in standard conditions, making it suitable for laboratory uses where liquid organic compounds are required. The compound should be handled in a well-ventilated area due to its characteristic odor.

Melting point (Celsius)
15.00
Melting point (Kelvin)
288.00
Boiling point (Celsius)
333.00
Boiling point (Kelvin)
606.00
General information
Molecular weight
213.31g/mol
Molar mass
213.3070g/mol
Density
1.2380g/cm3
Appearence

Cyclohexyl 2-thiocyanatoacetate is typically a colorless to pale yellow liquid. It exhibits a characteristic sulfur-like odor due to the presence of the thiocyanate group in the molecule. Its appearance can also encompass a light oil-like consistency that is clear and may become slightly opaque or hazy if impurities are present.

Comment on solubility

Solubility of Cyclohexyl 2-Thiocyanatoacetate

Cyclohexyl 2-thiocyanatoacetate is an intriguing compound with notable solubility characteristics that can greatly influence its applications in various fields. Understanding its solubility can help predict its behavior in different environments. Here are some key points to consider:

  • Polar Nature: The presence of the thiocyanate group (–SCN) typically enhances solubility in polar solvents such as water and alcohols due to its ability to form hydrogen bonds.
  • Hydrophobic Character: The cyclohexyl ring contributes hydrophobic characteristics, which may limit solubility in highly polar solvents while favoring solubility in organic solvents like ether or chloroform.
  • Temperature Influence: An increase in temperature can sometimes enhance solubility, helping to dissolve more of the compound into a solvent.
  • Concentration Factor: At higher concentrations, the solubility may be affected due to saturation effects, which can lead to precipitate formation.

In conclusion, the solubility profile of cyclohexyl 2-thiocyanatoacetate results from a delicate balance between its polar and nonpolar characteristics. Navigating this balance is crucial for maximizing its effectiveness in applications such as organic synthesis and materials science.

Interesting facts

Interesting Facts about Cyclohexyl 2-Thiocyanatoacetate

Cyclohexyl 2-thiocyanatoacetate is a compound that showcases intriguing chemical properties and potential applications in various fields. Here are some captivating aspects:

  • Thiocyanate Group: The presence of the thiocyanate group (–SCN) in this compound is noteworthy as it can influence both its reactivity and biological activity. Thiocyanates are known for their ability to form complexes with metal ions, which may lead to novel applications in coordination chemistry.
  • Biological Relevance: Thiocyanates have been studied for their roles in several biological systems. Compounds featuring the thiocyanate moiety have shown potential in areas such as anti-cancer research, indicating that cyclohexyl 2-thiocyanatoacetate might hold promise in medicinal chemistry.
  • Agrochemical Potential: Due to its structural characteristics, the compound can be explored for use as a pesticide or herbicide. Its ability to disrupt certain biological processes in target organisms can make it valuable in agricultural applications.
  • Solvent Properties: The cyclohexyl group in this compound confers interesting solvent properties that can enhance its performance in organic synthesis reactions, particularly in non-polar environments.
  • Versatility in Synthesis: Cyclohexyl 2-thiocyanatoacetate can be synthesized through various methods, allowing chemists to explore different pathways in organic synthesis. This versatility enriches its relevance in academic and industrial research.

"The magic of chemistry lies in the countless compounds we can create and explore, each with unique properties and potential applications."

The exploration of cyclohexyl 2-thiocyanatoacetate not only deepens our understanding of thiocyanate chemistry but also inspires future research and innovation. The potential applications in pharmaceuticals and agriculture highlight the importance of this compound in the broader context of chemical sciences.

Synonyms
Cyklohexylthiokyanoacetat
5349-27-9
ACETIC ACID, THIOCYANATO-, CYCLOHEXYL ESTER
Cyklohexylester kyseliny thiokyanooctove
H2NM9K22RG
NSC-1200
Cyklohexylthiokyanoacetat [Czech]
Thiocyanatoacetate cyclohexyl ester
NSC 1200
Cyklohexylester kyseliny thiokyanooctove [Czech]
BRN 3259501
UNII-H2NM9K22RG
WLN: L6TJ AOV1SCN
Cyklohexylester kyseliny thiokyanooctove [Czech]
DTXSID20201673
NSC1200
CYCLOHEXANOL, THIOCYANATOACETATE
ACETIC ACID, 2-THIOCYANATO-, CYCLOHEXYL ESTER