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Phenobarbital

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Identification
Molecular formula
C12H19N2O3
CAS number
50-06-6
IUPAC name
5-ethyl-1,3-dimethyl-5-(1-methylbutyl)hexahydropyrimidine-2,4,6-trione
State
State

At room temperature, phenobarbital is in a solid state, specifically a crystalline powder, making it stable under normal conditions of storage and handling.

Melting point (Celsius)
175.00
Melting point (Kelvin)
448.00
Boiling point (Celsius)
400.00
Boiling point (Kelvin)
673.00
General information
Molecular weight
254.29g/mol
Molar mass
254.2890g/mol
Density
1.0996g/cm3
Appearence

Phenobarbital is typically found as a white, odorless, and tasteless crystalline powder. It is highly soluble in alcohol and slightly soluble in water.

Comment on solubility

Solubility of 5-ethyl-1,3-dimethyl-5-(1-methylbutyl)hexahydropyrimidine-2,4,6-trione

The solubility of 5-ethyl-1,3-dimethyl-5-(1-methylbutyl)hexahydropyrimidine-2,4,6-trione can be influenced by various factors, including its molecular structure and the nature of the solvent. This compound, being a complex organic molecule, presents unique solubility characteristics.

Key Points About Solubility:

  • Polarity: The compound contains multiple functional groups that may enhance its interaction with polar solvents like water.
  • Hydrophobic Regions: The presence of long alkyl chains may lead to hydrophobic characteristics, potentially reducing solubility in aqueous environments.
  • Solvent Selection: Solubility might be improved in organic solvents such as ethanol or acetone, which can better accommodate non-polar regions of the molecule.

In summary, while the solubility of 5-ethyl-1,3-dimethyl-5-(1-methylbutyl)hexahydropyrimidine-2,4,6-trione may not be straightforward, it likely behaves differently in various solvents, showcasing the intricate balance between polar and non-polar interactions. A deeper exploration into specific solubility data would provide a more comprehensive understanding of this compound's behavior in solution.

Interesting facts

Interesting Facts about 5-ethyl-1,3-dimethyl-5-(1-methylbutyl)hexahydropyrimidine-2,4,6-trione

The compound 5-ethyl-1,3-dimethyl-5-(1-methylbutyl)hexahydropyrimidine-2,4,6-trione is a fascinating member of the pyrimidine family, which is known for its diverse applications in medicinal chemistry and organic synthesis. Here are some engaging insights about this interesting compound:

  • Structural Complexity: This molecule features a multi-substituted hexahydropyrimidine core, contributing to its unique structural and chemical properties. The combination of ethyl, dimethyl, and (1-methylbutyl) groups plays a crucial role in influencing its reactivity and interactions.
  • Biological Relevance: Pyrimidine derivatives are pivotal in the biosynthesis of nucleic acids. This specific compound may potentially offer insights into the design of new pharmaceuticals and therapeutic agents due to its structural similarities to nucleobases.
  • Chemo-diversity: The distinct and varied functional groups present in this compound make it an excellent candidate for studying chemical reactions that can lead to the synthesis of even more complex molecules. Chemists often explore the reactivity of such compounds to develop innovative synthesis routes.
  • Potential Applications: Investigations into this compound may reveal usage in agrochemicals, as many pyrimidine-derivatives exhibit herbicidal and fungicidal properties, thus highlighting their importance in crop protection.
  • Research Opportunities: The unique properties of this compound invite research into its interactions with biological systems, potentially leading to new discoveries in drug development and enhanced understanding of molecular mechanisms.

In summary, 5-ethyl-1,3-dimethyl-5-(1-methylbutyl)hexahydropyrimidine-2,4,6-trione is not just a complex chemical structure, but also a gateway to numerous scientific explorations that can impact fields ranging from pharmaceuticals to agricultural sciences. The potential of such compounds continues to excite and inspire ongoing research in chemistry.

Synonyms
28239-47-6
BARBITURIC ACID, 1,3-DIMETHYL-5-ETHYL-5-(1-METHYLBUTYL)-
RefChem:1077475
Dimethylpentobarbital
1,3-Dimethylpentobarbital
N,N'-Dimethylpentobarbital
1,3-Dimethyl-5-ethyl-5-(1-methylbutyl)barbituric acid
2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-1,3-dimethyl-5-(1-methylbuthyl)-
BRN 0235039
Pentobarbital, 1,3-dimethyl
DTXSID50950960
VZZFPHAKJNPXQY-UHFFFAOYSA-N
Barbituric acid, 5-ethyl-1,3-dimethyl-5-(1-methylbutyl)-
2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-1,3-dimethyl-5-(1-methylbutyl)-
1,3-Dimethyl derivative of Pentobarbital
NS00113950
5-Ethyl-1,3-dimethyl-5-(1-methylbutyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
5-ETHYL-1,3-DIMETHYL-5-(PENTAN-2-YL)-1,3-DIAZINANE-2,4,6-TRIONE