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3,4,4a,5,6,7,8,8a-octahydro-2H-chromen-2-one

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Identification
Molecular formula
C9H14O2
CAS number
62393-05-1
IUPAC name
3,4,4a,5,6,7,8,8a-octahydrochromen-2-one
State
State

At room temperature, 3,4,4a,5,6,7,8,8a-octahydro-2H-chromen-2-one is typically a liquid that can easily be discerned by its color and viscosity.

Melting point (Celsius)
47.00
Melting point (Kelvin)
320.15
Boiling point (Celsius)
261.00
Boiling point (Kelvin)
534.15
General information
Molecular weight
154.21g/mol
Molar mass
154.2060g/mol
Density
1.0470g/cm3
Appearence

The compound appears as a colorless to pale yellow liquid. Its clarity can vary depending on its purity, and it may be slightly viscous depending on the temperature.

Comment on solubility

Solubility of 3,4,4a,5,6,7,8,8a-Octahydrochromen-2-one

The solubility of 3,4,4a,5,6,7,8,8a-octahydrochromen-2-one, a bicyclic compound, can be intriguing due to its structural characteristics. Here are some key points regarding its solubility:

  • Polar vs. Non-Polar: As a compound with multiple carbon atoms and a relatively complex structure, its solubility in water is likely to be low. This is due to the predominance of non-polar carbon-hydrogen (C-H) bonds compared to functional groups that might engage in hydrogen bonding.
  • Solvent Compatibility: It may exhibit greater solubility in organic solvents such as acetone, ethanol, or dichloromethane compared to water, making it suitable for usage in various organic synthesis entailing non-polar environments.
  • Temperature Influence: Like many organic compounds, solubility can be affected by temperature. An increase in temperature often enhances solubility in non-polar solvents.
  • Practical Implications: Understanding the solubility of 3,4,4a,5,6,7,8,8a-octahydrochromen-2-one is essential for its applications in pharmaceuticals and organic chemistry, as solubility influences bioavailability and reaction conditions.

In summary, the solubility of this compound reflects its structural attributes and interactions with solvents, making it a subject of interest for chemists looking into organic materials.

Interesting facts

Interesting Facts About 3,4,4a,5,6,7,8,8a-Octahydrochromen-2-one

3,4,4a,5,6,7,8,8a-Octahydrochromen-2-one, often referred to as a versatile compound, plays a notable role in various fields of chemistry and material science. Here are some remarkable insights about this compound:

  • Structural Versatility: This compound exhibits an interesting fused ring structure, allowing it to demonstrate unique chemical properties and reactivities that can be harnessed in synthetic organic chemistry.
  • Applications in Medicine: Compounds similar to octahydrochromen-2-one have garnered attention in pharmaceutical research due to their potential therapeutic properties. They are often studied for their implications in developing drugs with anti-inflammatory or antiviral activities.
  • Chemical Reactivity: The presence of the carbonyl group (ketone) in the structure makes this compound an intriguing candidate for various organic reactions, including nucleophilic additions and cycloadditions, facilitating the synthesis of more complex molecules.
  • Natural Occurrence: Some derivatives of 3,4,4a,5,6,7,8,8a-octahydrochromen-2-one are found in nature as components of essential oils. This highlights its significance in biochemistry and the natural sciences.
  • Synthetic Pathways: The synthesis of octahydrochromen-2-one has been a topic of interest for chemists, with various methodologies explored, including multi-step reactions that showcase the compound's reactivity and utility.
  • Research Opportunities: There is ongoing research into the derivatives and analogs of octahydrochromen-2-one, exploring new applications in agricultural chemistry and materials science, revealing its potential beyond just organic synthesis.

In conclusion, 3,4,4a,5,6,7,8,8a-octahydrochromen-2-one embodies a fascinating intersection of organic chemistry, medicinal research, and synthetic innovation. As researchers continue to explore its properties, the compound stands as a testament to the complexity and utility of chemical compounds in science.

Synonyms
Octahydrocoumarin
4430-31-3
Octahydro-2H-1-benzopyran-2-one
Cyclohexyllactone
Bicyclononalactone
Cyclohexyl lactone
Octahydro-1-benzopyran-2-one
2H-1-Benzopyran-2-one, octahydro-
FEMA No. 3791
COUMARIN, OCTAHYDRO-
EINECS 224-623-4
AI3-28142
H6VNF31DVW
DTXSID7052105
OCTAHYDROCOUMARIN [FHFI]
DTXCID9030672
CYCLOHEXANEPROPANOIC ACID, 2-HYDROXY-, GAMMA-LACTONE
CYCLOHEXANEPROPIONIC ACID, 2-HYDROXY-, GAMMA-LACTONE
CYCLOHEXANEPROPANOIC ACID, 2-HYDROXY-, .GAMMA.-LACTONE
CYCLOHEXANEPROPIONIC ACID, 2-HYDROXY-, .GAMMA.-LACTONE
Octahydro-2H-chromen-2-one
3,4,4a,5,6,7,8,8a-octahydrochromen-2-one
Octahydrochromen-2-one
MFCD00221714
UNII-H6VNF31DVW
perhydrocoumarin
octahydrocoumarine
octahydro-coumarin
Octahydrocoumarin, 8CI
SCHEMBL113746
Octahydro-2H-chromen-2-one #
CHEBI:180439
STL560925
AKOS006241606
NCGC00178178-01
2-Hydroxycyclohexanepropanoic acid lactone
DS-19651
SY316402
DB-070530
CS-0063175
NS00013054
D73280