Skip to main content

Methyl 2-thiocyanatoacetate

ADVERTISEMENT
Identification
Molecular formula
C5H7NO2S
CAS number
54743-34-1
IUPAC name
methyl 2-thiocyanatoacetate
State
State

At room temperature, methyl 2-thiocyanatoacetate is in a liquid state. It flows easily and is miscible with many organic solvents but less so with water due to its mixed functional groups.

Melting point (Celsius)
-14.00
Melting point (Kelvin)
259.15
Boiling point (Celsius)
220.00
Boiling point (Kelvin)
493.15
General information
Molecular weight
145.17g/mol
Molar mass
145.1730g/mol
Density
1.2290g/cm3
Appearence

Methyl 2-thiocyanatoacetate is typically a colorless to pale yellow liquid. It is known for its relatively low viscosity and a characteristic, somewhat pungent odor due to the presence of the thiocyanate group.

Comment on solubility

Solubility of Methyl 2-thiocyanatoacetate

Methyl 2-thiocyanatoacetate, with the chemical formula C4H7NO2S, exhibits distinctive solubility characteristics that can vary significantly depending on the solvent used.

Solubility Characteristics:

  • Polar Solvents: Methyl 2-thiocyanatoacetate demonstrates moderate solubility in polar solvents like water and alcohols due to its ability to form hydrogen bonds.
  • Non-polar Solvents: In contrast, it tends to be more soluble in organic solvents such as ether and chloroform, where the lack of polarity allows for favorable interactions.
  • Temperature Effects: Increased temperature typically enhances solubility, making it crucial to consider temperature variations in experimental settings.

As with many organic thiocyanates, the presence of the thiocyanate group (–SCN) contributes to its unique polarizability and solubility properties, which can be crucial for applications in synthesis and material science. Therefore, understanding the solubility behavior of methyl 2-thiocyanatoacetate can be particularly beneficial in designing experiments and predicting its interactions with other substances.

Interesting facts

Interesting Facts about Methyl 2-Thiocyanatoacetate

Methyl 2-thiocyanatoacetate is a fascinating compound that plays a significant role in organic chemistry and is notable for its unique properties. Here are some intriguing facts about this compound:

  • Functional Group: This compound contains both thio and ester functional groups, combining the characteristics of thiocyanates and esters. This fusion leads to interesting reactivity and versatility in chemical reactions.
  • Uses in Synthesis: Methyl 2-thiocyanatoacetate is often utilized in the synthesis of other chemical compounds, particularly in the manufacture of pharmaceuticals and agrochemicals. Its derivatives can lead to compounds with various biological activities.
  • Biological Activity: Compounds that include the thioester moiety are frequently studied for their potential pharmacological applications. Research has shown that similar thiocyanate-containing compounds may exhibit antimicrobial and antitumor properties, making them crucial in medicinal chemistry.
  • Resource for Research: As a chemical intermediate, methyl 2-thiocyanatoacetate serves as a valuable resource for chemists working in both academic and industrial settings, providing a building block for more complex structures.
  • Environmental Impact: Understanding the behavior and degradation of compounds like methyl 2-thiocyanatoacetate is essential for assessing their environmental impact, especially in relation to agricultural use and chemical regulation.

In summary, methyl 2-thiocyanatoacetate not only represents an essential tool in synthetic organic chemistry but also offers potential insights into the development of new therapeutic agents. Its unique composition and reactivity make it a subject of interest for many researchers exploring innovative chemical applications.

Synonyms
Thiocyanatoacetic acid methyl ester
689-77-0
methyl thiocyanatoacetate
ACETIC ACID, THIOCYANATO-, METHYL ESTER
methyl thiocyanoacetate
Thiocyano-essigsaeure-methyl-ester
T6602L6PQD
NSC-4092
methyl 2-thiocyanatoacetate
Acetic acid, 2-thiocyanato-, methyl ester
NSC 4092
BRN 1751314
Thiocyano-essigsaeure-methyl-ester [German]
WLN: NCS1VO1
UNII-T6602L6PQD
SCHEMBL6397282
DTXSID90218975
NSC4092
WZVLGZCYSGZXPQ-UHFFFAOYSA-N
DS-011419