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Batrachotoxin

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Identification
Molecular formula
C31H42N2O6
CAS number
23509-16-2
IUPAC name
dimethyl 12-ethyl-4-(17-ethyl-17-hydroxy-13-methoxycarbonyl-1,11-diazatetracyclo[13.3.1.04,12.05,10]nonadeca-4(12),5,7,9-tetraen-13-yl)-10-hydroxy-5-methoxy-8-methyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6,13-tetraene-10,11-dicarboxylate
State
State
At room temperature, batrachotoxin exists as a waxy solid, which is very potent and verges on being an amorphous material. It is primarily used in scientific research due to its complex activity and high toxicity.
Melting point (Celsius)
120.00
Melting point (Kelvin)
393.15
Boiling point (Celsius)
330.00
Boiling point (Kelvin)
603.15
General information
Molecular weight
538.64g/mol
Molar mass
538.6360g/mol
Density
1.2287g/cm3
Appearence

Batrachotoxin is typically a colorless to light pale yellow waxy solid. It is a highly potent and naturally occurring alkaloid toxin.

Comment on solubility

Solubility of Dimethyl 12-ethyl-4-(17-ethyl-17-hydroxy-13-methoxycarbonyl-1,11-diazatetracyclo[13.3.1.04,12.05,10]nonadeca-4(12),5,7,9-tetraen-13-yl)-10-hydroxy-5-methoxy-8-methyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6,13-tetraene-10,11-dicarboxylate

The compound with the complex name and chemical formula C31H42N2O6 displays intriguing solubility characteristics. Understanding its solubility can significantly impact its practical applications in fields such as medicinal chemistry and materials science.

Factors Affecting Solubility

Several factors influence the solubility of this compound:

  • Polarity: The presence of multiple functional groups, such as hydroxyl (-OH) and carboxyl (-COOH) groups, can enhance hydrogen bonding, promoting solubility in polar solvents like water.
  • Molecular Size: The large and complex structure may hinder solubility due to steric hindrance, potentially making it less soluble in non-polar solvents.
  • Temperature: As with many compounds, increased temperature generally enhances solubility, particularly in organic solvents.
  • pH Levels: This compound may display pH-dependent solubility, especially due to the carboxylic acid functionality, which can ionize in basic conditions, influencing its overall solubility.

General Insights

In conclusion, while we can infer certain solubility properties based on the structure of this compound, empirical testing under various conditions is essential to determine its precise solubility profile. As a guiding quote underscores, “The solubility of a compound often unveils its potential in applications.” Therefore, understanding the solubility behavior of this unique compound can unlock its potential uses in various scientific domains.

Interesting facts

Interesting Facts about Dimethyl 12-Ethyl-4-(17-ethyl-17-hydroxy-13-methoxycarbonyl-1,11-diazatetracyclo[13.3.1.04,12.05,10]nonadeca-4(12),5,7,9-tetraen-13-yl)-10-hydroxy-5-methoxy-8-methyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6,13-tetraene-10,11-dicarboxylate

This fascinating compound is a complex molecule with multiple functional groups and cyclic structures, showcasing the intricacies of organic chemistry at its finest. Here are some intriguing aspects about this compound:

  • Structural Diversity: The presence of numerous cyclic structures indicates a high degree of molecular complexity. This may result in unique physical and chemical properties that can be exploited in various applications.
  • Biological Significance: Compounds with such intricate frameworks are often found to have significant biological activities. They may interact with biological pathways, which could lead to potential medicinal applications, such as targeting specific diseases.
  • Natural Product Inspiration: Many compounds that resemble this structure are derived from natural sources. They exemplify the beauty of nature's chemistries and bring about a wealth of opportunities for synthetic chemists to explore natural product synthesis.
  • Potential for Research: Given the novelty of this compound, it could be a subject of intense research. Scientists might investigate its chemical reactivity, stability, and potential as a pharmaceutical agent.
  • Analytical Challenges: Due to the compound's size and complexity, analyzing and characterizing it using techniques like NMR or mass spectrometry can be quite challenging, yet rewarding.
  • Education in Action: For chemistry students, this compound serves as an exemplary case for discussions on topics such as stereochemistry, reactivity patterns, and the importance of molecular design in developing new materials or drugs.

In essence, dimethyl 12-ethyl-4-(...)dicarboxylate not only challenges our understanding of structural chemistry but also opens doors to innovative research and discovery.

Synonyms
Dimethyl 12-ethyl-4-(17-ethyl-17-hydroxy-13-methoxycarbonyl-1,11-diazatetracyclo[13.3.1.04,12.05,10]nonadeca-4(12),5,7,9-tetraen-13-yl)-10-hydroxy-5-methoxy-8-methyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6,13-tetraene-10,11-dicarboxylate
CHEBI:91589
LSM-1395
BRD-A22783572-065-01-3
Q27163422