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β-Selinene

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Identification
Molecular formula
C15H24
CAS number
17066-67-0
IUPAC name
(4aS,7S,8aR)-7-isopropenyl-4a-methyl-1-methylene-decalin
State
State

At room temperature, β-Selinene is in a liquid state, which is common for many sesquiterpenes.

Melting point (Celsius)
-63.00
Melting point (Kelvin)
210.15
Boiling point (Celsius)
245.00
Boiling point (Kelvin)
518.15
General information
Molecular weight
204.36g/mol
Molar mass
204.3600g/mol
Density
0.8609g/cm3
Appearence

β-Selinene is an oily liquid with a distinct woody odor, often associated with essential oils from plants. It is colorless to pale yellow.

Comment on solubility

Solubility of (4aS,7S,8aR)-7-isopropenyl-4a-methyl-1-methylene-decalin

The solubility of (4aS,7S,8aR)-7-isopropenyl-4a-methyl-1-methylene-decalin is influenced by its unique molecular structure, characterized by a complex arrangement of carbon atoms and functional groups. Generally, the solubility behavior of such organic compounds can be assessed through various factors:

  • Polarity: As a hydrocarbon, this compound is likely nonpolar, which typically results in higher solubility in nonpolar solvents.
  • Temperature: Increasing temperature usually improves solubility for many organic compounds, potentially allowing for better solvation in appropriate solvents.
  • Intermolecular Forces: The presence of functional groups can introduce polar interactions; however, in this case, with limited polar functionalities, solubility in water is expected to be low.
  • Solvent Compatibility: The compound may dissolve significantly in organic solvents such as hexane, dichloromethane, or ethanol, while remaining poorly soluble in water.

In conclusion, the solubility prospects for (4aS,7S,8aR)-7-isopropenyl-4a-methyl-1-methylene-decalin are best evaluated within nonpolar environments, promoting effective interactions with similar solvents and enhancing its overall solubility profile.

Interesting facts

Interesting Facts about (4aS,7S,8aR)-7-isopropenyl-4a-methyl-1-methylene-decalin

(4aS,7S,8aR)-7-isopropenyl-4a-methyl-1-methylene-decalin is a fascinating compound that belongs to the class of bicyclic hydrocarbons known as decalin derivatives. Its unique structure and functional groups make it a subject of interest in various fields of chemistry and material sciences.

Key Characteristics

  • Stereochemistry: This compound features a particular stereochemical configuration, with specific chiral centers that contribute to its unique properties and potential biological activity.
  • Naturally Occurring: Some derivatives of decalin are found in nature, primarily in essential oils and plant resins, which are crucial for studies in phytochemistry.
  • Reactive Sites: The isopropenyl group serves as a reactive site, which can lead to interesting derivatives through further chemical reactions, making it a valuable intermediate in organic synthesis.
  • Applications in Materials Science: Compounds similar to decalin derivatives are explored for applications in materials such as elastomers, coatings, and adhesives due to their desirable mechanical properties.

Interesting Uses

Researchers are increasingly interested in the potential uses of (4aS,7S,8aR)-7-isopropenyl-4a-methyl-1-methylene-decalin due to its unique structural characteristics:

  1. As a building block in organic synthesis to create more complex organic compounds.
  2. In the study of >steroidal structures, providing insights into the structure-activity relationship in medicinal chemistry.
  3. Potentially in fragrance chemistry, given its possible occurrence in aromatic compounds.

The exploration of (4aS,7S,8aR)-7-isopropenyl-4a-methyl-1-methylene-decalin opens up avenues for innovative research and applications in both academia and industry. Its complex chemistry demonstrates the intersection of theoretical and applied chemistry, showcasing how structural uniqueness can lead to a myriad of possibilities.

Synonyms
(-)-beta-selinene
(3S,4aR,8aS)-8a-methyl-5-methylidene-3-prop-1-en-2-yl-1,2,3,4,4a,6,7,8-octahydronaphthalene
CHEBI:49274
(4aS,7S,8aR)-7-isopropenyl-4a-methyl-1-methylenedecahydronaphthalene
(4aS,7S,8aR)-4a-methyl-1-methylidene-7-(prop-1-en-2-yl)decahydronaphthalene (5beta,7alpha,10alpha)-eudesma-4(14),11-diene
(5beta,7alpha,10alpha)-eudesma-4(14),11-diene
(4aS,7S,8aR)-4a-methyl-1-methylidene-7-(prop-1-en-2-yl)decahydronaphthalene
473-12-1
SCHEMBL29975200
YOVSPTNQHMDJAG-ZNMIVQPWSA-N
LMPR0103190010
5bH,7b,10a-selina-4(14),11-diene
Q27121583
Naphthalene, decahydro-4a-methyl-1-methylene-7-(1-methylethenyl)-, (4aR-(4aalpha,7alpha,8abeta))-