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Butyl 2-oxo-2-[3-(2H-tetrazol-5-yl)anilino]acetate

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Identification
Molecular formula
C13H16N4O3
CAS number
.603139-19-1
IUPAC name
butyl 2-oxo-2-[3-(2H-tetrazol-5-yl)anilino]acetate
State
State

At room temperature, butyl 2-oxo-2-[3-(2H-tetrazol-5-yl)anilino]acetate is in a solid state, specifically as crystalline powder. It should be handled carefully to avoid unnecessary exposure to moisture or light, which could alter its physical state and chemical stability over time.

Melting point (Celsius)
134.00
Melting point (Kelvin)
407.15
Boiling point (Celsius)
275.00
Boiling point (Kelvin)
548.15
General information
Molecular weight
340.36g/mol
Molar mass
340.3560g/mol
Density
1.4400g/cm3
Appearence

Butyl 2-oxo-2-[3-(2H-tetrazol-5-yl)anilino]acetate typically appears as a white to off-white crystalline powder. This compound is not highly hygroscopic and is generally stable at room temperature when stored in a dry environment. The powder may vary slightly in hue or texture depending on the specific synthesis method and purity.

Comment on solubility

Solubility of Butyl 2-oxo-2-[3-(2H-tetrazol-5-yl)anilino]acetate

Butyl 2-oxo-2-[3-(2H-tetrazol-5-yl)anilino]acetate, with the chemical formula C13H16N4O3, presents intriguing characteristics regarding its solubility. Understanding its solubility is crucial for various applications including biological activity and formulation processes.

Solubility Characteristics:

  • Polar and Nonpolar Interactions: The presence of the butyl group suggests a degree of hydrophobicity, while the ketone and tetrazole groups introduce polar characteristics.
  • Solvent Compatibility: This compound may show varying solubility in different solvents. It is likely to be soluble in organic solvents such as ethanol and DMSO, while exhibiting limited solubility in water due to its hydrophobic regions.
  • Temperature Influence: Like many organic compounds, solubility can also be influenced by temperature. Increasing temperature typically enhances solubility in organic solvents.
  • Aqueous Solutions: Although some derivatives of tetrazoles can be more soluble in water, this specific compound could be expected to have limited solubility, making it better suited for applications that do not rely on water as a solvent.

As a general observation, compounds with complex structures like butyl 2-oxo-2-[3-(2H-tetrazol-5-yl)anilino]acetate often require careful consideration when it comes to solubility. As noted, it is essential to conduct empirical solubility tests to accurately determine its behavior in various environments. The interplay between its hydrophobic and hydrophilic components will undoubtedly affect its practical utility and formulation potential.

Interesting facts

Interesting Facts about Butyl 2-oxo-2-[3-(2H-tetrazol-5-yl)anilino]acetate

Butyl 2-oxo-2-[3-(2H-tetrazol-5-yl)anilino]acetate is a fascinating compound that has garnered attention in various fields, particularly in pharmaceuticals and organic synthesis. Below are some intriguing points about this compound:

  • Structural Significance: The inclusion of a 2H-tetrazol-5-yl moiety adds unique chemical properties, enhancing the compound's potential biological activities.
  • Pharmaceutical Applications: This compound represents a class of molecules that may exhibit anti-inflammatory, anti-tumor, or antimicrobial properties. This makes it invaluable in medicinal chemistry research.
  • Synthetic Routes: The synthesis of butyl 2-oxo-2-[3-(2H-tetrazol-5-yl)anilino]acetate can involve various methods, including esterification reactions that highlight the versatility of organic synthesis techniques.
  • Bioactivity: Compounds containing both the acetyl and tetrazole functionalities often show interesting bioactivity due to their ability to interact with biological targets, making them subjects of ongoing studies and trials.
  • Research Relevance: Being a part of a growing family of tetrazole derivatives, understanding this compound can provide insights into the development of novel therapeutic agents.

In summary, butyl 2-oxo-2-[3-(2H-tetrazol-5-yl)anilino]acetate exemplifies the intersection of organic chemistry and medicinal research, highlighting the importance of compound structure in determining biological activity. Its unique components offer a rich field for exploration and discovery.

Synonyms
tazanolast
82989-25-1
Tazanol
Butyl 2-((3-(1H-tetrazol-5-yl)phenyl)amino)-2-oxoacetate
butyl 2-oxo-2-[3-(2H-tetrazol-5-yl)anilino]acetate
WP-833
5-(3-n-Butyloxalylaminophenyl)tetrazole
TO 188; Tazalest; Tazanol
CHEMBL564109
DTXSID6048626
NCGC00183655-01
T0248823H1
Tazanolastum
Tazalest
Tazanolast [INN:JAN]
Tazanolastum [INN-Latin]
Butyl 3'-(1H-tetrazol-5-yl)oxanilate
UNII-T0248823H1
Tazanol (TN)
TAZANOLAST [MI]
Oxo((3-(1H-tetrazol-5-yl)phenyl)amino)acetic acid butyl ester
Tazanolast (JAN/INN)
TAZANOLAST [INN]
TAZANOLAST [JAN]
TAZANOLAST [WHO-DD]
SCHEMBL28495
DTXCID3028552
CHEBI:32183
XQTARQNQIVVBRX-UHFFFAOYSA-N
Tox21_112967
Acetic acid, oxo((3-(1H-tetrazol-5-yl)phenyl)amino)-, butyl ester
BDBM50295559
AKOS016013960
CS-6660
MS-24130
CAS-82989-25-1
HY-101810
NS00126698
D01669
G12677
Q27289492
butyl 2-(3-(1H-tetrazol-5-yl)phenylamino)-2-oxoacetate
butyl {[3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]carbamoyl}formate