Skip to main content

Nivalenol

ADVERTISEMENT
Identification
Molecular formula
C15H20O8
CAS number
23282-20-4
IUPAC name
6-[7-[5-ethyl-5-(5-ethyl-5-hydroxy-6-methyl-tetrahydropyran-2-yl)-3-methyl-tetrahydrofuran-2-yl]-4-hydroxy-3,5-dimethyl-6-oxo-nonyl]-2-hydroxy-3-methyl-benzoic acid
State
State

At room temperature, nivalenol is in a solid state. It is often found as a crystalline powder, which is stable under normal temperature and pressure conditions.

Melting point (Celsius)
229.00
Melting point (Kelvin)
502.15
Boiling point (Celsius)
431.15
Boiling point (Kelvin)
704.30
General information
Molecular weight
312.33g/mol
Molar mass
312.3430g/mol
Density
1.3400g/cm3
Appearence

Nivalenol appears as a white, crystalline solid when in its pure form. It is typically handled as a powder and is known for being crystalline with a low melting point, indicative of its high purity.

Comment on solubility

Solubility of 6-[7-[5-ethyl-5-(5-ethyl-5-hydroxy-6-methyl-tetrahydropyran-2-yl)-3-methyl-tetrahydrofuran-2-yl]-4-hydroxy-3,5-dimethyl-6-oxo-nonyl]-2-hydroxy-3-methyl-benzoic acid (C15H20O8)

The solubility of complex organic compounds like 6-[7-[5-ethyl-5-(5-ethyl-5-hydroxy-6-methyl-tetrahydropyran-2-yl)-3-methyl-tetrahydrofuran-2-yl]-4-hydroxy-3,5-dimethyl-6-oxo-nonyl]-2-hydroxy-3-methyl-benzoic acid can be influenced by several factors. Here are key points to consider:

  • Polarity: The presence of multiple hydroxyl (–OH) groups generally enhances solubility in polar solvents such as water. This compound contains several hydroxyl groups that may contribute to its solubility.
  • Hydrophobic Regions: The alkyl chains and hydrocarbon components may lead to hydrophobic behavior, possibly leading to decreased solubility in polar solvents.
  • pH Influence: As a carboxylic acid, the solubility might vary with pH; in more basic conditions, it may become more soluble due to deprotonation, increasing its ionic character.
  • Temperature Dependency: Higher temperatures tends to increase the solubility of many organic compounds; this can be an important consideration for practical applications.

In summary, while the specific solubility profile of this compound may require empirical data for precise understanding, it is likely that a balance of polar and non-polar characteristics influences its solubility behavior. To determine the actual solubility, solubility testing in various solvents would be essential.

Interesting facts

Interesting Facts about 6-[7-[5-ethyl-5-(5-ethyl-5-hydroxy-6-methyl-tetrahydropyran-2-yl)-3-methyl-tetrahydrofuran-2-yl]-4-hydroxy-3,5-dimethyl-6-oxo-nonyl]-2-hydroxy-3-methyl-benzoic acid

This compound, recognized for its complex structure, showcases the fascinating interplay of synthetic organic chemistry and natural product chemistry. Here are some intriguing insights:

  • Complexity of Structure: The compound features a multifaceted arrangement of functional groups, highlighting the beauty and diversity found in organic molecules. With its multiple rings and functional groups, it presents numerous potential interaction sites, making it a topic of interest in medicinal chemistry.
  • Potential Biological Activity: Compounds of this nature often exhibit interesting biological activities, possibly functioning as modulators in biochemical pathways. Investigating their mechanisms could unravel new therapeutic avenues. As we say in the lab, "Sometimes the most complex molecules yield the simplest solutions."
  • Synthetic Challenges: The synthesis of such intricate compounds often requires innovative strategies and a deep understanding of reaction mechanisms. Chemists must carefully consider conditions such as temperature, solvent choice, and catalysts to successfully construct the desired molecular framework.
  • Application in Drug Development: Given its structure, there may be a promising role for this compound in the design of pharmaceuticals, particularly in developing drugs targeting specific pathways or conditions influenced by hydroxybenzoic acids.

In summary, the examination of this compound not only expands our understanding of chemical diversity but also reinforces the importance of structure-function relationships in the field of drug discovery. The potential implications of its structural features are a reminder of the incredible innovation present within chemical science.

Synonyms
ANTIBIOTIC X-536A
Bovatec R
11054-70-9
Antibiotic X 537
6-[7-[5-ethyl-5-(5-ethyl-5-hydroxy-6-methyloxan-2-yl)-3-methyloxolan-2-yl]-4-hydroxy-3,5-dimethyl-6-oxononyl]-2-hydroxy-3-methylbenzoic acid
NSC177406
1,4:5,9-dianhydro-1-[9-(2-carboxy-3-hydroxy-4-methylphenyl)-6-hydroxy-5,7-dimethyl-4-oxononan-3-yl]-2,3,6,7-tetradeoxy-4-ethyl-8-c-ethyl-2,9-dimethylnonitol
CHEMBL96040
SCHEMBL10817445
DTXSID30860356
NSC-177406
NCI60_001946
NS00085053