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Bromoxynil

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Identification
Molecular formula
C7H2BrCl2NO2
CAS number
1689-84-5
IUPAC name
2,4,5-trichloro-6-hydroxy-benzene-1,3-dicarbonitrile
State
State

Bromoxynil is typically found as a solid at room temperature. It may be used in formulating products where it is dissolved or suspended.

Melting point (Celsius)
192.00
Melting point (Kelvin)
465.15
Boiling point (Celsius)
390.00
Boiling point (Kelvin)
663.15
General information
Molecular weight
241.48g/mol
Molar mass
241.4780g/mol
Density
1.8780g/cm3
Appearence

Bromoxynil appears as white to grey crystals. It can also be seen in a crystalline powder form, often used in its sodium salt or octanoate ester forms for agricultural applications.

Comment on solubility

Solubility of 2,4,5-trichloro-6-hydroxy-benzene-1,3-dicarbonitrile

The solubility of 2,4,5-trichloro-6-hydroxy-benzene-1,3-dicarbonitrile can be influenced by several factors due to its complex structure. Understanding these factors is essential for practical applications:

  • Polarity: The presence of multiple chlorine atoms and a hydroxy group suggests that the compound may exhibit a degree of polarity, which can affect its solubility in various solvents.
  • Hydrogen Bonding: The hydroxy group can engage in hydrogen bonding, potentially increasing solubility in polar solvents like water.
  • Solvent Interaction: The solubility in organic solvents may vary; for example, it might dissolve better in ethanol or dimethyl sulfoxide (DMSO) compared to non-polar solvents.
  • Temperature: As with many organic compounds, solubility may increase with an increase in temperature.

It is important to note that while data on its exact solubility is limited, theoretical predictions can provide valuable insights. As with many chlorinated compounds, there may be concerns regarding environmental persistence and toxicity, affecting its practical usage and handling:

  • Solvent safety: Proper precautions should be taken when testing for solubility due to potential hazards.
  • Environmental impact: The persistence of such compounds in nature can lead to regulatory scrutiny.

Overall, determining the solubility of 2,4,5-trichloro-6-hydroxy-benzene-1,3-dicarbonitrile requires careful consideration of its chemical properties and the context in which it is used.

Interesting facts

Interesting Facts about 2,4,5-Trichloro-6-hydroxy-benzene-1,3-dicarbonitrile

This intriguing compound, commonly known in scientific circles, boasts a multifaceted structure that captures the attention of both chemists and researchers. Here are some key highlights:

  • Chemical Structure: The compound is characterized by the presence of multiple chlorine atoms and hydroxyl groups, linked to a benzene ring with dicarbonitrile functionalities. This configuration contributes to its unique chemical properties, influencing its reactivity and interactions.
  • Uses: 2,4,5-Trichloro-6-hydroxy-benzene-1,3-dicarbonitrile has found various applications in the field of agrochemicals, particularly as a precursor or intermediate in the synthesis of herbicides and pesticides, making it valuable for enhancing agricultural productivity.
  • Synthetic Pathways: The synthesis of this compound often involves complex multi-step reactions, demonstrating the ingenuity required in organic chemistry. Such processes can include halogenation, hydroxylation, and nitration, all of which play pivotal roles in forming the final product.
  • Biological Activity: Preliminary studies have indicated that compounds like 2,4,5-trichloro-6-hydroxy-benzene-1,3-dicarbonitrile possess noteworthy biological activities, potentially leading to applications in pharmaceuticals or biochemistry, where they may exhibit antimicrobial or antifungal properties.

In conclusion, 2,4,5-trichloro-6-hydroxy-benzene-1,3-dicarbonitrile is not just a simple chemical entity; it embodies the intricate dance of chemical reactivity, practical applications in modern science, and the ongoing quest for substance discovery. As we continue to explore such compounds, their potential for innovation remains boundless.

Synonyms
28343-61-5
4-Hydroxy-2,5,6-trichloroisophthalonitrile
hydroxychlorothalonil
4-Hydroxy-2,5,6-trichloro-1,3-benzenedicarbonitrile
IQJ3P52AEE
DTXSID90182586
RefChem:523727
DTXCID30105077
2,4,5-trichloro-6-hydroxybenzene-1,3-dicarbonitrile
Hydroxy Chlorothalonil
CHLOROTHALONIL-4-HYDROXY
4-hydroxychlorothalonil
C8HCl3N2O
1,3-Benzenedicarbonitrile, 2,4,5-trichloro-6-hydroxy-
1,3-Benzenedicarbonitrile, 4-hydroxy-2,5,6-trichloro-
2,4,5-Trichloro-6-hydroxyisophthalonitrile
Isophthalonitrile, 2,4,5-trichloro-6-hydroxy-
2,4,5-TRICHLORO-6-HYDROXY-1,3-BENZENEDICARBONITRILE
BRN 2653044
UNII-IQJ3P52AEE
chlorothalonil TP1
4-Hydroxy chlorothalonil
Chlorothalonil-4-hydroxy 10 microg/mL in Acetonitrile
SCHEMBL8886111
CHEMBL3248146
CHEBI:133542
MDQKYGOECVSPIW-UHFFFAOYSA-N
DBA34361
MSK21378
MFCD00152214
AKOS033199375
4-hydroxy-2,5,6-trichloroisophtalonitrile
CS-0252299
NS00002719
2,4,5-Trichloro-6-hydroxy- isophthalonitrile
2,4,5-Trichloro-6-hydroxyisophthalonitrile #
EN300-59735
R182281 (SDS-19221)
2,4,5-trichloro-6-hydroxy-benzene-1,3-dicarbonitrile
Q27280855
1,3-DICYANO-4-HYDROXY-2,5,6-TRICHLOROBENZENE
Z916926806
2,4,5-Trichloro-6-hydroxyisophthalonitrile, analytical standard
2,5,6-TRICHLORO-4-HYDROXY-1,3-BENZENEDICARBONITRILE