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Isoquinoline

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Identification
Molecular formula
C9H7N
CAS number
89-12-5
IUPAC name
5-(4-isopropylsulfonylphenyl)-7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinoline
State
State

At room temperature, isoquinoline exists in a solid state. It is often encountered as crystals.

Melting point (Celsius)
106.00
Melting point (Kelvin)
379.15
Boiling point (Celsius)
382.00
Boiling point (Kelvin)
655.15
General information
Molecular weight
169.21g/mol
Molar mass
169.2090g/mol
Density
1.2400g/cm3
Appearence

The compound typically appears as a light yellow crystalline powder. It is usually handled as a solid.

Comment on solubility

Solubility of 5-(4-isopropylsulfonylphenyl)-7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinoline

The solubility of the compound 5-(4-isopropylsulfonylphenyl)-7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinoline is an intriguing topic due to its complex molecular structure. Understanding its solubility characteristics can offer vital insights into its potential applications and efficacy. Here are some key points regarding its solubility:

  • Polar and Nonpolar Interactions: Given the presence of the isopropylsulfonyl group, the compound may display a balance of polar and nonpolar characteristics, influencing its solubility in various solvents.
  • Solvent Specificity: The solubility may vary greatly in different solvents. It is likely to show higher solubility in polar aprotic solvents compared to nonpolar solvents.
  • Influence of Functional Groups: The sulfonyl and dioxole groups can enhance interactions with polar solvents, potentially leading to increased solubility.
  • Temperature Dependency: Like many organic compounds, solubility is likely to be affected by temperature, with increased temperatures generally leading to enhanced solubility.

In summary, while specific empirical solubility data for this compound may be limited, it is essential to consider the complex interplay of various factors, including solvent type, temperature, and molecular interactions. Such understanding not only aids in practical applications but also fosters further research into the compound's properties and uses.

Interesting facts

Interesting Facts about 5-(4-isopropylsulfonylphenyl)-7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinoline

5-(4-isopropylsulfonylphenyl)-7,8-dihydro-[1,3]dioxolo[4,5-g]isoquinoline represents a fascinating avenue in the study of organic chemistry, particularly within the realm of heterocyclic compounds. Its unique structure displays a dioxoloisoquinoline backbone, which is not only interesting for theoretical exploration but also holds potential practical applications.

Key Highlights:

  • Versatile Applications: Compounds of this class are often investigated for their biological activity, possibly serving as leads in drug development.
  • Synthetic Pathways: The synthesis of such complex molecules typically requires advanced techniques and may involve multi-step reactions, showcasing the ingenuity of modern organic synthesis.
  • Structure-Activity Relationship (SAR): The substitution patterns in this compound allow researchers to study how variations impact the biological properties, offering rich data for medicinal chemistry.
  • Potential Therapeutic Uses: Due to their structural motif, isoquinolines have been associated with various pharmacological effects, including anti-inflammatory, analgesic, and antimicrobial activities.

As new synthetic methods evolve, compounds like this one illustrate the creativity and challenge inherent in organic chemistry. Their study not only advances our understanding of chemical principles but also opens doors to new therapeutic possibilities. In the words of Francis Crick, "Discovery is looking at the same thing as everyone else and thinking something different." This mindset is essential when exploring the intricacies of such unique compounds.

Synonyms
BRN 1602123
20884-94-0
1,3-DIOXOLO(4,5-g)ISOQUINOLINE, 7,8-DIHYDRO-5-(p-(ISOPROPYLSULFONYL)PHENYL)-
DTXSID50175010
3,4-Dihydro-1-(p-(isopropylsulfonyl)phenyl)-6,7-(methylenedioxy)isoquinoline
7,8-Dihydro-5-(p-(isopropylsulfonyl)phenyl)-1,3-dioxolo(4,5-g)isoquinoline
DTXCID3097501
RefChem:219032