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Ethyl 3-[[1-(isopentylcarbamoyl)-3-methyl-butyl]carbamoyl]oxirane-2-carboxylate

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Identification
Molecular formula
C17H29N2O5
CAS number
/
IUPAC name
ethyl 3-[[1-(isopentylcarbamoyl)-3-methyl-butyl]carbamoyl]oxirane-2-carboxylate
State
State
The compound is a liquid at room temperature.
Melting point (Celsius)
-10.00
Melting point (Kelvin)
263.15
Boiling point (Celsius)
322.00
Boiling point (Kelvin)
595.15
General information
Molecular weight
299.39g/mol
Molar mass
299.3890g/mol
Density
1.2000g/cm3
Appearence

Ethyl 3-[[1-(isopentylcarbamoyl)-3-methyl-butyl]carbamoyl]oxirane-2-carboxylate appears as a colorless to pale yellow liquid. It may exhibit a faint odor typical of organic esters, and it is often used as a reagent in organic synthesis, particularly in formulations requiring specific acetate ester motifs.

Comment on solubility

Solubility of Ethyl 3-[[1-(isopentylcarbamoyl)-3-methyl-butyl]carbamoyl]oxirane-2-carboxylate

The solubility of ethyl 3-[[1-(isopentylcarbamoyl)-3-methyl-butyl]carbamoyl]oxirane-2-carboxylate (C17H29N2O5) can be influenced by several factors, primarily due to the compound's complex structure. This molecule features both hydrophilic and hydrophobic regions, which play a critical role in determining its interaction with solvents. Here are some key points regarding its solubility:

  • Polar vs. Non-Polar Solvents: Given its carbamoyl and carboxylate functional groups, the compound is expected to have better solubility in polar solvents such as water or alcohols, though it may still show some degree of solubility in non-polar solvents.
  • Temperature Dependence: Solubility typically increases with temperature, so heating the solvent may enhance the dissolution of this compound.
  • Concentration Effects: At higher concentrations, solubility can be affected by saturation levels, which might lead to precipitation if the solubility limit is exceeded.
  • pH Sensitivity: The carboxylic acid part of the structure can become ionized depending on the pH of the solution, further affecting its solubility in aqueous environments.

In summary, while ether ethyl 3-[[1-(isopentylcarbamoyl)-3-methyl-butyl]carbamoyl]oxirane-2-carboxylate may possess moderate solubility in certain solvents, understanding and optimizing the conditions of solubility is essential for effective use in various applications.

Interesting facts

Interesting Facts about Ethyl 3-[[1-(Isopentylcarbamoyl)-3-methyl-butyl]carbamoyl]oxirane-2-carboxylate

Ethyl 3-[[1-(isopentylcarbamoyl)-3-methyl-butyl]carbamoyl]oxirane-2-carboxylate is a unique compound with intriguing characteristics that make it noteworthy in the field of chemistry. Here are some exciting details:

  • Synthetic Origins: This compound belongs to a class of oxiranes, which are known for their versatile applications in organic synthesis, particularly in the creation of complex molecules.
  • Pharmacological Potential: Researchers are exploring compounds like this one for their potential pharmaceutical applications, especially in drug design due to their unique structural features. Isopentylcarbamoyl groups introduce interesting reactivity and specificity.
  • Functional Groups: The presence of multiple carbamoyl functional groups enhances the compound's biochemical interactions, which could be beneficial in herbal and medicinal chemistry.
  • Structure-Activity Relationship (SAR): Studying this compound can help chemists understand how different structural modifications impact biological activity, which is crucial for drug development.

In summary, Ethyl 3-[[1-(isopentylcarbamoyl)-3-methyl-butyl]carbamoyl]oxirane-2-carboxylate stands as an impressive example of the intricacies of organic chemistry. As we continue to study its properties and potential applications, we may uncover transformative uses that can influence various fields, from medicinal chemistry to materials science.

Synonyms
96244-68-7
Ethyl 3-(3-methyl-1-(3-methylbutylcarbamoyl)butylcarbamoyl)-2-oxiranecarboxylate
ethyl 3-[[4-methyl-1-(3-methylbutylamino)-1-oxopentan-2-yl]carbamoyl]oxirane-2-carboxylate
E-64-d
L-trans-Epoxysuccinyl-Leu-3-methylbutylamide-ethyl ester
L-EST
Epoxysuccinyl-leucylamide(3-methyl)butane ethyl ester
ethyl 3-({4-methyl-1-[(3-methylbutyl)amino]-1-oxopentan-2-yl}carbamoyl)oxirane-2-carboxylate
Ethyl epoxysuccinyl-leucylamido-3-methylbutane
med.21724, Compound 27
CHEMBL2355020
SCHEMBL18498407
DTXSID30869001
BDBM429291
HMS3370L19
HMS3653O20
IED-4321-V
NCGC00163691-01
LS-14611
SW220094-1
BRD-A12987505-001-01-9
Oxiranecarboxylic acid, 3-(((3-methyl-1-(((3-methylbutyl)amino)carbonyl)butyl)amino)carbonyl)-, ethyl ester