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Ethyl 4-(trifluoromethylsulfonyl)-3-benzoylphenylcarbamate

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Identification
Molecular formula
C17H14F3NO5S
CAS number
123855-66-3
IUPAC name
ethyl N-(3-benzoylphenyl)-N-(trifluoromethylsulfonyl)carbamate
State
State

At room temperature, ethyl N-(3-benzoylphenyl)-N-(trifluoromethylsulfonyl)carbamate is in a solid state. It is generally handled as a crystalline powder in laboratory environments.

Melting point (Celsius)
68.00
Melting point (Kelvin)
341.15
Boiling point (Celsius)
472.00
Boiling point (Kelvin)
745.15
General information
Molecular weight
375.33g/mol
Molar mass
375.3310g/mol
Density
1.3860g/cm3
Appearence

Ethyl N-(3-benzoylphenyl)-N-(trifluoromethylsulfonyl)carbamate is typically a crystalline solid. It generally presents itself as an off-white to pale yellow solid depending on its purity and form.

Comment on solubility

Solubility of Ethyl N-(3-benzoylphenyl)-N-(trifluoromethylsulfonyl)carbamate

When examining the solubility of ethyl N-(3-benzoylphenyl)-N-(trifluoromethylsulfonyl)carbamate, it is important to consider its structural features and the nature of its chemical groups. This compound contains a trifluoromethyl group, which is known for its influence on solubility characteristics.

Factors affecting solubility:

  • Polarity: The presence of polar functional groups can enhance solubility in polar solvents, whereas non-polar sections may favor solubility in non-polar solvents.
  • Hydrogen bonding: The potential for hydrogen bonding in the structure can significantly affect solubility in water and other polar solvents.
  • Size and Mass: Larger molecular size typically can lead to lower solubility due to steric hindrance.

In summary, ethyl N-(3-benzoylphenyl)-N-(trifluoromethylsulfonyl)carbamate is likely to exhibit limited solubility in water due to its complex aromatic structure. However, it may dissolve more readily in organic solvents such as ethanol, acetone, or other polar organic solvents due to its aromatic and sulfonyl components. Overall, the solubility profile is influenced by both polar and non-polar interactions, making it essential to evaluate its behavior in various environments for practical applications.

Interesting facts

Ethyl N-(3-benzoylphenyl)-N-(trifluoromethylsulfonyl)carbamate: Intriguing Insights

This compound represents a fascinating integration of functional groups, making it a notable subject in the realm of organic chemistry. With a trifluoromethylsulfonyl group attached to a carbamate, it opens avenues for diverse applications in pharmaceuticals and agrochemicals. Here are some interesting aspects to consider:

  • Structure and Function: The presence of the trifluoromethyl group significantly influences the compound's properties. This moiety is known for increasing lipophilicity, which can enhance biological activity and improve membrane penetration in biological systems.
  • Reactivity: The combination of the benzoyl and carbamate functionalities allows for potential reactivity in different synthetic pathways, making this compound a valuable intermediate in organic synthesis.
  • Pesticidal and Medicinal Potential: Compounds featuring trifluoromethyl or carbamate groups are often explored for their activity against pests, pathogens, and even for their medicinal properties. The trifluoromethylsulfonyl moiety may confer specific bioactivity that enhances both efficacy and selectivity.
  • Research Applications: Due to its unique structure, it can serve as a tool in synthetic chemistry—facilitating research into new medicinal compounds or agricultural chemicals that exhibit desired pharmacological or toxicological profiles.

In summary, ethyl N-(3-benzoylphenyl)-N-(trifluoromethylsulfonyl)carbamate captures interest due to its innovative structure and the multifaceted roles it can play in scientific exploration. As research progresses, compounds like this can reveal novel pathways to creation and application in both pharmacy and agriculture.

Synonyms
Triflumidate
24243-89-8
Triflumidato
Triflumidatum
BA 4223
MBR 4223
BA-4223
V6G94Z48FK
Ethyl m-benzoyl-N-((trifluoromethyl)sulfonyl)carbanilate
MBR-4223
DTXSID80178938
Carbamic acid, (3-benzoylphenyl)((trifluoromethyl)sulfonyl)-, ethyl ester
(3-Benzoylphenyl)((trifluoromethyl)sulfonyl)carbamic acid, ethyl ester
RefChem:933400
DTXCID40101429
N-ethoxycarbonyl-3-benzoyltrifluoromethanesulfonanilide
ethyl N-(3-benzoylphenyl)-N-(trifluoromethylsulfonyl)carbamate
Triflumidate [USAN:INN]
Triflumidatum [INN-Latin]
Triflumidato [INN-Spanish]
BRN 2955261
UNII-V6G94Z48FK
Triflumidate (USAN/INN)
TRIFLUMIDATE [INN]
TRIFLUMIDATE [USAN]
CHEMBL2106503
SCHEMBL29360936
ULANGSAJTINEBA-UHFFFAOYSA-N
CARBANILIC ACID, m-BENZOYL-N-((TRIFLUOROMETHYL)SULFONYL)-, ETHYL ESTER
NS00125709
D06232
Q27291592