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4,4-dimethyl-1,3-benzoxazin-2-one

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Identification
Molecular formula
C10H9NO2
CAS number
30766-22-2
IUPAC name
4,4-dimethyl-1H-3,1-benzoxazin-2-one
State
State

At room temperature, 4,4-dimethyl-1,3-benzoxazin-2-one is a solid, owing to its crystalline structure. This stability and solid form are pivotal for its storage and usage in industrial applications.

Melting point (Celsius)
142.00
Melting point (Kelvin)
415.15
Boiling point (Celsius)
270.00
Boiling point (Kelvin)
543.15
General information
Molecular weight
177.20g/mol
Molar mass
177.1960g/mol
Density
1.1830g/cm3
Appearence

The compound 4,4-dimethyl-1,3-benzoxazin-2-one generally appears as a white to slightly off-white crystalline powder. The crystalline structure lends it a specific texture and opacity.

Comment on solubility

Solubility of 4,4-dimethyl-1H-3,1-benzoxazin-2-one

The compound 4,4-dimethyl-1H-3,1-benzoxazin-2-one exhibits interesting solubility properties that can be essential for its various applications. Solubility is often influenced by several factors, including:

  • Polarity: This compound possesses polar functional groups that can interact favorably with polar solvents.
  • Hydrogen Bonding: The presence of the oxazinone moiety allows it to form hydrogen bonds with water, enhancing its solubility in aqueous environments.
  • Temperature: Like many organic compounds, its solubility can increase with temperature; thus, heating solvents can improve dissolution rates.

In general, 4,4-dimethyl-1H-3,1-benzoxazin-2-one is expected to have moderate solubility in common organic solvents such as methanol or ethanol, while it may show limited solubility in non-polar solvents due to its polar characteristics. It is important to note that solubility can vary with concentration, and the compound may crystallize out of solution if conditions change. In projects involving this compound, understanding its solubility behavior is crucial for optimizing formulations and reactions.

As always, empirical testing is recommended to ascertain precise solubility metrics under specific conditions.

Interesting facts

Interesting Facts about 4,4-Dimethyl-1H-3,1-benzoxazin-2-one

4,4-Dimethyl-1H-3,1-benzoxazin-2-one, commonly referred to within the scientific community, is a compound that piques curiosity due to its intriguing properties and applications. Here are some fascinating insights:

  • Natural Occurrence: This compound is a synthetic derivative that can be found in several natural plants, suggesting a potential role in plant defense mechanisms.
  • Biological Activity: Research has indicated that 4,4-dimethyl-1H-3,1-benzoxazin-2-one exhibits significant biological activities, particularly in antimicrobial and anti-inflammatory applications, making it an attractive candidate for pharmaceutical research.
  • Molecular Structure Insights: The unique benzoxazine structure contributes to its stability and reactivity. The 3,1-benzoxazine ring is crucial for many of its chemical properties and reactivity which could be exploited in materials science.
  • Potential in Agriculture: This compound has been studied for its herbicidal properties, indicating its potential usefulness in agricultural chemistry as a bioactive agent against unwanted plant species.
  • Application in Polymers: Due to its benzoxazine structure, it has been investigated as a component for advanced polymers, where it demonstrates potential as a thermosetting agent, which can provide strength and thermal resistance.
  • Ongoing Research: The exploration of this compound continues in various disciplines, including medicinal chemistry and environmental science, helping to broaden our understanding of its functions and applications.

In conclusion, 4,4-dimethyl-1H-3,1-benzoxazin-2-one is not just a compound of niche interest; it embodies a wealth of possibilities that chemical scientists and researchers are eager to unlock. As the exploration of its features continues, this compound's contributions to several fields could be transformative.

Synonyms
21440-96-0
4H-3,1-BENZOXAZIN-2-ONE, 1,2-DIHYDRO-4,4-DIMETHYL-
BRN 0640981
1,2-Dihydro-4,4-dimethyl-4H-3,1-benzoxazin-2-one
DTXSID00175707
RefChem:297452
DTXCID4098198
4,4-dimethyl-1H-3,1-benzoxazin-2-one
4,4-Dimethyl-1H-benzo[d][1,3]oxazin-2(4H)-one
MFCD01664027
SCHEMBL631642
SCHEMBL3077800
SCHEMBL3377796
DXRDETPOBPURRD-UHFFFAOYSA-N
BS-25007
4,4-dimethyl-1,4-dihydrobenzo[d][1,3]oxazin-2-one
4,4-dimethyl-2,4-dihydro-1H-3,1-benzoxazin-2-one
4,4-dimethyl-1,4-dihydro-benzo[d][1,3]oxazin-2-one
4,4-Dimethyl-1,4-dihydro-2H-benzo[d][1,3]oxazin-2-one