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Ethyl 3-azatricyclo[3.2.1.02,4]octane-3-carboxylate

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Identification
Molecular formula
C10H15NO2
CAS number
31330-22-6
IUPAC name
ethyl 3-azatricyclo[3.2.1.02,4]octane-3-carboxylate
State
State

At room temperature, ethyl 3-azatricyclo[3.2.1.02,4]octane-3-carboxylate is typically a solid. It may exhibit polymorphism, which can result in slightly different physical appearances or melting points for different samples.

Melting point (Celsius)
85.00
Melting point (Kelvin)
358.00
Boiling point (Celsius)
200.00
Boiling point (Kelvin)
473.00
General information
Molecular weight
195.25g/mol
Molar mass
195.2480g/mol
Density
1.1200g/cm3
Appearence

Ethyl 3-azatricyclo[3.2.1.02,4]octane-3-carboxylate typically appears as a solid, crystalline substance. The color may vary depending on the level of purity but generally presents as a white to off-white substance.

Comment on solubility

Solubility of Ethyl 3-Azatricyclo[3.2.1.02,4]octane-3-carboxylate

The solubility of ethyl 3-azatricyclo[3.2.1.02,4]octane-3-carboxylate in various solvents can vary significantly based on its unique structure. In general, the solubility characteristics of this compound can be summarized as follows:

  • Polar Solvents: This compound exhibits limited solubility in polar solvents such as water due to its hydrophobic nature imparted by the tricyclic structure.
  • Non-Polar Solvents: It tends to have higher solubility in non-polar solvents like hexane or chloroform, where the molecular interactions are more favorable.
  • Alkyl Alcohols: Moderate solubility may be observed in lower alkyl alcohols (e.g., ethanol), where the presence of the ethyl group can enhance interaction.

In practical applications, understanding the solubility behavior of ethyl 3-azatricyclo[3.2.1.02,4]octane-3-carboxylate is crucial, as it influences factors such as:

  1. **Formulation Development:** Determining how this compound can be integrated into various formulations.
  2. **Bioavailability:** Understanding how solubility can affect its absorption in biological systems.
  3. **Reactivity:** Predicting how the compound interacts with other chemicals based on solubility.

In summary, while ethyl 3-azatricyclo[3.2.1.02,4]octane-3-carboxylate showcases varying solubility across different solvent types, its non-polar interactions tend to dominate, making it less soluble in polar environments. This highlights the intricate relationship between molecular structure and solubility.

Interesting facts

Interesting Facts about Ethyl 3-Azatricyclo[3.2.1.02,4]octane-3-carboxylate

Ethyl 3-azatricyclo[3.2.1.02,4]octane-3-carboxylate is a fascinating compound that belongs to a class of organic molecules known for their unique structural properties. Here are some key points to consider:

  • Unique Structure: This compound features a bicyclic structure that incorporates nitrogen, lending itself to intriguing chemical behavior. The presence of nitrogen in the ring system often alters the reactivity compared to purely carbon-based structures.
  • Synthetic Applications: Compounds similar to ethyl 3-azatricyclo[3.2.1.02,4]octane-3-carboxylate are often used in organic synthesis. They can serve as intermediates in the production of more complex molecules, including pharmaceuticals and agrochemicals.
  • Biological Relevance: The architecture of this compound suggests potential biological activity. Compounds that share similar structural features can act as enzyme inhibitors or receptor modulators in various biochemical pathways.
  • Research Interest: Chemists are continually investigating compounds like this for their potential effects in medicinal chemistry, particularly in the development of novel therapeutic agents targeting specific diseases.
  • Substituent Effects: The ethyl ester functional group enhances the solubility of the compound in organic solvents, making it a useful derivative for further chemical transformations.

In summary, ethyl 3-azatricyclo[3.2.1.02,4]octane-3-carboxylate is not just a simple compound; it embodies the intersection of organic chemistry and pharmacology. Its unique bicyclic and azatricyclic nature emphasizes the beauty and complexity of molecular architecture.

Synonyms
943-34-0
NSC 82085
Ethyl 3-azatricyclo(3.2.1.0(sup2,4))octane-3-carboxylate
Ethyl 3-azatricyclo(3.2.1.0(sup 2,4))octane-3-carboxylate
3-AZATRICYCLO(3.2.1.0(sup 2,4))OCTANE-3-CARBOXYLIC ACID, ETHYL ESTER
3-Azatricyclo(3.2.1.02,4)octane-3-carboxylic acid, ethyl ester
Ethyl 3-azatricyclo[3.2.1.0(sup2,4)]octane-3-carboxylate
3-Azatricyclo(3.2.1.02,4)octane-3-carboxylic acid, ethyl ester (8CI)
NSC82085
NCIOpen2_000840
DTXSID90915694
DZOOLBXFQXIOFA-UHFFFAOYSA-N
NSC-82085
3-Azatricyclo[3.2.1.02, ethyl ester
3-Azatricyclo[3.2.1.0(sup2, ethyl ester
Ethyl 3-azatricyclo[3.2.1.0~2,4~]octane-3-carboxylate