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3-isopropyl-5-(2-oxo-1,3-benzodioxol-5-yl)oxazolidin-2-one

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Identification
Molecular formula
C13H13NO5
CAS number
64050-11-7
IUPAC name
3-isopropyl-5-(2-oxo-1,3-benzodioxol-5-yl)oxazolidin-2-one
State
State

At room temperature, this compound is typically found as a crystalline solid.

Melting point (Celsius)
142.00
Melting point (Kelvin)
415.15
Boiling point (Celsius)
335.50
Boiling point (Kelvin)
608.65
General information
Molecular weight
263.27g/mol
Molar mass
263.2670g/mol
Density
1.3000g/cm3
Appearence

The compound typically appears as a crystalline solid. It may be colorless or white, depending on its purity.

Comment on solubility

Solubility Insights for 3-isopropyl-5-(2-oxo-1,3-benzodioxol-5-yl)oxazolidin-2-one

The solubility of the compound 3-isopropyl-5-(2-oxo-1,3-benzodioxol-5-yl)oxazolidin-2-one can be influenced by a variety of factors including polar and non-polar interactions, molecular size, and functional groups present.

Key Factors Influencing Solubility:

  • Polarity: This compound features both hydrophobic (isopropyl group) and hydrophilic (carbonyl and ether functionalities) regions, leading to mixed solubility characteristics.
  • Solvent Type: Its solubility is likely greater in organic solvents such as ethanol and DMSO, while it may have limited solubility in water due to its larger non-polar sections.
  • Temperature: Increased temperature generally enhances solubility for most compounds, potentially making it more soluble in hot organic solvents.

In general, compounds with similar structure often exhibit trends in solubility behaviors:

  1. The presence of multiple oxygen atoms (as seen in the benzodioxole structure) can introduce significant hydrogen bonding with polar solvents.
  2. Challenging steric factors from bulky groups, like the isopropyl moiety, may hinder interactions with polar solvents, complicating solubility.

In summary, while predicting the precise solubility of 3-isopropyl-5-(2-oxo-1,3-benzodioxol-5-yl)oxazolidin-2-one requires empirical data, understanding these key factors can guide expectations about its behavior in various environments.

Interesting facts

Interesting Facts about 3-isopropyl-5-(2-oxo-1,3-benzodioxol-5-yl)oxazolidin-2-one

The compound 3-isopropyl-5-(2-oxo-1,3-benzodioxol-5-yl)oxazolidin-2-one is a fascinating member of the oxazolidinone family, notable for its intriguing structure and potential applications in various scientific fields. Here are some engaging insights:

  • Pharmaceutical Potential: This compound is of significant interest in medicinal chemistry due to its structural resemblance to established antibiotics. Oxazolidinones are known for their ability to inhibit bacterial protein synthesis, making compounds like this a subject of ongoing research in the formulation of new antibacterial therapies.
  • Unique Structure: The combination of an oxazolidinone ring and a benzodioxole moiety contributes to its unique properties. The benzodioxole portion is especially noteworthy as it is commonly found in a variety of biologically active natural products.
  • Versatility in Synthesis: The synthesis of this compound can be approached through various synthetic pathways, showcasing the versatility of organic reactions. This allows for the introduction of different functional groups to tailor the compound for specific applications.
  • Research and Development: The ongoing research surrounding compounds of this nature paves the way for innovations in drug design and development. Scientists continue to explore how modifications to the oxazolidinone core can enhance efficacy and reduce side effects in clinical applications.
  • Importance of Structure-Activity Relationship (SAR): Understanding the SAR of this compound is crucial. It helps scientists ascertain how varying the isopropyl group or modifying the benzodioxole component affects biological activity, thus guiding future developments.

In conclusion, 3-isopropyl-5-(2-oxo-1,3-benzodioxol-5-yl)oxazolidin-2-one is not just a chemical compound; it represents an exciting intersection of chemistry and pharmacology. As research progresses, who knows what groundbreaking discoveries may emerge from studying this intriguing molecule!

Synonyms
CEJ40QV5EH
2-Oxazolidinone, 3-(1-methylethyl)-5-(2-oxo-1,3-benzodioxol-5-yl)-
23271-77-4
5-(3,4-Carbonyldioxyphenyl)-3-isopropyl-2-oxazolidinone
UNII-CEJ40QV5EH
5-(3',4'-Carbonyldioxyphenyl)-3-isopropyl-2-oxazolidinone