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Barbituric acid derivative

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Identification
Molecular formula
C9H13NO3
CAS number
80-44-4
IUPAC name
5,5-diethyl-1,3-oxazinane-2,4-dione
State
State

At room temperature, the compound is generally in a solid state, usually existing as crystalline or powder form, indicating it is stable under standard conditions.

Melting point (Celsius)
125.00
Melting point (Kelvin)
398.15
Boiling point (Celsius)
285.40
Boiling point (Kelvin)
558.50
General information
Molecular weight
184.20g/mol
Molar mass
184.2040g/mol
Density
1.2600g/cm3
Appearence

The compound is typically a crystalline solid. It can appear as a white or off-white powder depending on its purity and the exact derivative structure being examined.

Comment on solubility

Solubility of 5,5-diethyl-1,3-oxazinane-2,4-dione

The solubility of 5,5-diethyl-1,3-oxazinane-2,4-dione, a compound characterized by its unique oxazinane structure, is influenced by several factors including polarity, molecular size, and interactions with solvents. Here are some key points regarding its solubility:

  • Polarity: Due to the presence of multiple functional groups, the polarity of the compound plays a significant role in determining its solubility in various solvents.
  • Solvent Compatibility: This compound is generally more soluble in polar solvents, particularly those with hydrogen bonding capabilities, such as:
    • Water
    • Ethanol
    • Dimethyl sulfoxide (DMSO)
  • Temperature Effects: Like many organic compounds, solubility may increase with temperature, suggesting that heating the solvent may enhance the dissolution of 5,5-diethyl-1,3-oxazinane-2,4-dione.
  • Concentration Factors: At high concentrations, self-association may occur leading to decreased solubility, which is important to consider in practical applications.

In summary, while 5,5-diethyl-1,3-oxazinane-2,4-dione may exhibit good solubility in certain solvents, it's essential to consider the balance between solvent characteristics and compound interactions. As always, conducting specific solubility tests is recommended to confirm behavior in different solvent systems.

Interesting facts

Interesting Facts about 5,5-diethyl-1,3-oxazinane-2,4-dione

The compound 5,5-diethyl-1,3-oxazinane-2,4-dione is a fascinating member of the class of compounds known as oxazines, which are cyclic amines featuring oxygen in their ring structure. Here are some intriguing insights into this compound:

  • Structural Importance: The presence of both ethyl groups at the 5-position of the oxazinane ring significantly influences the compound's reactivity. This branching can enhance the steric hindrance, impacting how the molecule interacts with other substances.
  • Biological Applications: Compounds like 5,5-diethyl-1,3-oxazinane-2,4-dione are often studied for their potential biological activities. Their unique structure could lend them properties relevant in pharmaceuticals, such as acting as enzyme inhibitors or interacting with biological receptors.
  • Privileged Structure: The oxazine moiety is considered a "privileged scaffold." This means that it serves as a versatile framework for developing various biologically active compounds, aiding chemists in drug design.
  • Synthesis Pathways: The synthesis of 5,5-diethyl-1,3-oxazinane-2,4-dione typically involves multi-step organic reactions, showcasing the ingenuity required in synthetic organic chemistry.
  • Potential in Material Science: Beyond biological applications, the compound’s structural properties may also find utility in material science, particularly in the development of polymers or molecules with specific electronic properties.

Overall, 5,5-diethyl-1,3-oxazinane-2,4-dione exemplifies how a seemingly simple compound can have multifaceted implications in science, particularly in fields such as pharmacology, materials science, and synthetic chemistry.

Synonyms
Diethadione
Dioxone
702-54-5
Dietadiona
DIETHADION
Dietadione [Italian]
Diethadionum
Dietadione
Dietadiona [INN-Spanish]
Diethadionum [INN-Latin]
Diethadione [INN:BAN:DCF]
HSDB 5514
UNII-Z0SPD4Z01X
EINECS 211-867-1
NSC 169418
NSC-169418
BRN 0133129
DIETHADIONE [MI]
DIETHADIONE [INN]
DIETHADIONE [HSDB]
5,5-Dietildiidro-1,3-ossazin-2,4-dione [Italian]
5,5-Dietildiidro-1,3-ossazin-2,4-dione
DTXSID0061032
4-27-00-03263 (Beilstein Handbook Reference)
Dietadiona (INN-Spanish)
Diethadionum (INN-Latin)
DTXCID0046642
5,5-Diethyltetrahydro-2H-1,3-oxazine-2,4(3H)-dione
211-867-1
ortymghcfwkxho-uhfffaoysa-n
Persisten
Dietroxin
Ledosten
Toce
5,5-diethyl-1,3-oxazinane-2,4-dione
Dietroxine
Lepton
Tocen
L 1811
Z0SPD4Z01X
5,5-Diethyldihydro-2H-1,3-oxazine-2,4(3H)-dione
5,5-Diethyl-1,3-oxazin-2,4-dione
5,5-Diethyl-1,3-oxazine-2,4-dione
Dihydro-5,5-diethyl-2H-1,3-oxazine-2,4(3H)-dione
2H-1,3-Oxazine-2,4(3H)-dione, 5,5-diethyldihydro-
Diidro-5,5-dietil-2H-1,3-ossazin-2,4(3H)-dione [Italian]
5,3-oxazine-2,4-dione
SCHEMBL78320
CHEMBL96868
Diidro-5,5-dietil-2H-1,3-ossazin-2,4(3H)-dione
WLN: T6OVMVTJ E2 E2
5,3-oxazine-2,4(3H)-dione
CHEBI:134803
AAA70254
NSC169418
AKOS006271448
2H-1,4(3H)-dione, 5,5-diethyldihydro-
DS-002730
HY-121469
CS-0082148
NS00037029
EN300-258022
G76856
Q27294840
Z1198155402