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Identification
Molecular formula
C9H21N3
CAS number
36890-68-3
IUPAC name
2-(1,1,3,3-tetramethylbutyl)guanidine
State
State
At room temperature, the compound is typically in a liquid state.
Melting point (Celsius)
-30.00
Melting point (Kelvin)
243.15
Boiling point (Celsius)
143.00
Boiling point (Kelvin)
416.15
General information
Molecular weight
157.28g/mol
Molar mass
157.2720g/mol
Density
0.8150g/cm3
Appearence
The compound is a colorless to pale yellow liquid with a pungent odor. It may turn yellow upon prolonged exposure to air due to oxidation.
Comment on solubility

Solubility of 2-(1,1,3,3-tetramethylbutyl)guanidine

2-(1,1,3,3-tetramethylbutyl)guanidine is a complex organic compound exhibiting distinctive solubility characteristics. Understanding its solubility profile is crucial for its practical applications in various fields, especially in organic synthesis and biochemical processes. Here are some key points regarding its solubility:

  • Polar vs. Nonpolar: This compound possesses a polar guanidine functional group combined with a bulky alkyl chain, which creates a unique balance between its polar and nonpolar regions.
  • Solvent Compatibility: 2-(1,1,3,3-tetramethylbutyl)guanidine is likely to be soluble in polar protic solvents such as water and methanol, as well as in some nonpolar solvents like hexane. However, the overall solubility may depend on specific conditions like temperature.
  • Hydrogen Bonding: The presence of an amine nitrogen in the guanidine structure allows for the formation of hydrogen bonds with solvents, enhancing its solubility in aqueous media.
  • Influence of Structure: The steric hindrance caused by the bulky tetramethylbutyl group can limit solubility in certain solvents, affecting the compound's behavior in various solutions.

In summary, the solubility of 2-(1,1,3,3-tetramethylbutyl)guanidine is a compelling study of its functional group interactions and structural implications. As with many organic compounds, its solubility depends on numerous factors, making it an interesting subject for further research and application.

Interesting facts

Interesting Facts about 2-(1,1,3,3-tetramethylbutyl)guanidine

2-(1,1,3,3-tetramethylbutyl)guanidine is a fascinating compound with numerous notable attributes. Here are some interesting facts for both chemistry enthusiasts and professionals:

  • Reactivity: As a guanidine derivative, this compound showcases properties typical of guanidines, including acting as a strong base. It often participates in various chemical reactions, particularly in catalysis.
  • Applications: This compound has found its place in several fields. It is particularly relevant in medicinal chemistry, as it serves as a potential intermediate in the synthesis of biologically active molecules.
  • Functional Group Characteristics: The guanidine functional group is known for its ability to engage in hydrogen bonding. This makes 2-(1,1,3,3-tetramethylbutyl)guanidine an excellent candidate for studies in supramolecular chemistry.
  • Analytical Techniques: Researchers often utilize several analytical methods to study the properties and behavior of this compound. Techniques such as NMR, IR spectroscopy, and mass spectrometry are common for insightful investigations.
  • Structure-Activity Relationship (SAR): The bulky tert-butyl groups significantly impact the compound's overall steric and electronic properties, which can be a point of intrigue when examining structure-activity relationships in pharmacology.

In conclusion, 2-(1,1,3,3-tetramethylbutyl)guanidine stands out in the world of chemistry not just for its unique structure but also for its potential applications and reactivity. This compound demonstrates how even seemingly complex molecules can be pivotal in advancing current scientific understanding and innovative developments.

Synonyms
Guanoctine
3658-25-1
Guanoctine [INN]
guanoctina
Guanidine, (1,1,3,3-tetramethylbutyl)-
UNII-I108531358
A-7283 FREE BASE
BP-1184 FREE BASE
DTXSID7075002
I108531358
(1,1,3,3-TETRAMETHYLBUTYL)GUANIDINE
guanoctinum
DTXCID5039199
2-(2,4,4-trimethylpentan-2-yl)guanidine
t-octylguanidine
SCHEMBL5909699
CHEMBL2111168
AKOS011667548
N-(1,1,3,3-Tetramethylbutyl)guanidine
DB-417724
Q27280223