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Simazine

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Identification
Molecular formula
C21H33Cl6N3
CAS number
1918-16-7
IUPAC name
2-heptadecyl-4,6-bis(trichloromethyl)-1,3,5-triazine
State
State

At room temperature, this compound is typically a solid. It maintains its solid state owing to the relative strength of intermolecular forces within its crystal lattice, ensuring it's stable under standard conditions without sublimating or decomposing.

Melting point (Celsius)
225.00
Melting point (Kelvin)
498.20
Boiling point (Celsius)
240.00
Boiling point (Kelvin)
513.20
General information
Molecular weight
201.67g/mol
Molar mass
201.6650g/mol
Density
1.3000g/cm3
Appearence

2-heptadecyl-4,6-bis(trichloromethyl)-1,3,5-triazine, more commonly referred to as Simazine when speaking of the triazine group of compounds, typically presents itself as an off-white crystalline solid. The crystals are generally finely powdered, and they do not possess a significant odor, making it identifiable by sight over scent.

Comment on solubility

Solubility of 2-heptadecyl-4,6-bis(trichloromethyl)-1,3,5-triazine

The solubility of 2-heptadecyl-4,6-bis(trichloromethyl)-1,3,5-triazine can be quite intriguing due to its unique molecular structure. Here are some key points regarding its solubility characteristics:

  • Polarity: This compound is significantly nonpolar due to the long heptadecyl chain, which affects its interaction with various solvents.
  • Solvent Compatibility: It is likely to be more soluble in nonpolar organic solvents such as:
    • Chloroform
    • Benzene
    • Hexane
  • Water Solubility: Given its nonpolar characteristics, 2-heptadecyl-4,6-bis(trichloromethyl)-1,3,5-triazine is expected to have very low solubility in water.
  • Temperature Influence: Solubility may increase with temperature in nonpolar solvents, a common trait observed in many organic compounds.

In summary, the solubility of 2-heptadecyl-4,6-bis(trichloromethyl)-1,3,5-triazine in various solvents largely depends on its nonpolar nature, which makes it primarily compatible with nonpolar solvents while remaining insoluble in polar solvents like water.

Interesting facts

Interesting Facts about 2-Heptadecyl-4,6-bis(trichloromethyl)-1,3,5-triazine

2-Heptadecyl-4,6-bis(trichloromethyl)-1,3,5-triazine, a compound belonging to the triazine family, is captivating to study due to its unique structure and applications. Here are some notable aspects:

  • Triazine Framework: The triazine core is intriguing because it consists of three nitrogen atoms in a six-membered ring, which plays a critical role in the reactivity of the compound.
  • Chlorinated Functionality: The presence of trichloromethyl groups enhances the electrophilic character of the triazine, making it a potent molecule in various chemical reactions.
  • Applications in Agrochemicals: This compound is noteworthy for its use in the agricultural sector, particularly as a herbicide. Its structural features contribute to its effectiveness against a range of weeds.
  • Environmental Concerns: The chlorinated nature raises important environmental considerations. The persistence of trichloromethyl groups can lead to bioaccumulation, prompting ongoing research into its ecological impact.
  • Analytical Chemistry: Scientists often utilize advanced techniques such as chromatography to analyze and quantify this compound in different matrices, showcasing its relevance in analytical studies.

In summary, the compound 2-heptadecyl-4,6-bis(trichloromethyl)-1,3,5-triazine represents a fascinating intersection of organic chemistry and environmental science, drawing attention for both its utility and the critical discussions it incites regarding sustainability and safety in chemical use.

Synonyms
2-heptadecyl-4,6-bis(trichloromethyl)-1,3,5-triazine
DTXSID50274956
24481-35-4
RefChem:261368
DTXCID00226405
2-heptadecyl-4,6-bis(trichloromethyl)-symm-triazine