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6-Chloro-3-(hydroxymethyl)-1,3-benzoxazol-2-one

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Identification
Molecular formula
C8H6ClNO3
CAS number
10534-59-5
IUPAC name
6-chloro-3-(hydroxymethyl)-1,3-benzoxazol-2-one
State
State

At room temperature, this compound is in a solid state, appearing as crystalline powder.

Melting point (Celsius)
182.00
Melting point (Kelvin)
455.15
Boiling point (Celsius)
360.00
Boiling point (Kelvin)
633.15
General information
Molecular weight
201.56g/mol
Molar mass
201.5560g/mol
Density
1.5780g/cm3
Appearence

The compound appears as a white to off-white crystalline solid. It is typically stable under standard conditions and does not exhibit any distinct odor.

Comment on solubility

Solubility of 6-chloro-3-(hydroxymethyl)-1,3-benzoxazol-2-one

The solubility of 6-chloro-3-(hydroxymethyl)-1,3-benzoxazol-2-one is influenced by several factors, which are crucial for its application in various chemical and biological contexts. Here are some key points to consider:

  • Solvent Compatibility: This compound may exhibit varying solubility in different solvents. Generally, it is expected to be more soluble in polar solvents due to the presence of the hydroxymethyl group, which can engage in hydrogen bonding.
  • Temperature Dependence: As with many organic compounds, solubility can increase with temperature. Higher temperatures typically provide more kinetic energy to dissolve the solute.
  • pH Effects: The ionization of the compound can be influenced by the pH of the solution. This may especially apply to the hydroxymethyl group, altering its solubility characteristics.
  • Concentration Limitations: It is important to note the maximum concentration that can be achieved before saturation occurs, as solubility limits impact the kinetics of reactions involving this compound.

Overall, while specific numerical solubility data may not be readily available, understanding these factors can significantly aid in predicting and optimizing the solubility of 6-chloro-3-(hydroxymethyl)-1,3-benzoxazol-2-one in practical applications.

Interesting facts

Interesting Facts About 6-Chloro-3-(hydroxymethyl)-1,3-benzoxazol-2-one

6-Chloro-3-(hydroxymethyl)-1,3-benzoxazol-2-one, often referred to in the lab or literature as a structurally intriguing compound, showcases a fascinating blend of functional groups that contributes to its unique properties. Here are some key insights:

  • Chemical Structure: The compound contains a benzoxazole moiety which is significant in medicinal chemistry. This bicyclic structure is known for its role in various biological activities.
  • Potential Applications: Compounds like benzoxazol derivatives are studied for their potential as antimicrobial, antifungal, and anti-inflammatory agents. Their varied biological activity makes them candidates for drug development.
  • Chlorination Impact: The presence of a chlorine atom in the structure often enhances lipophilicity, which can influence the compound's bioavailability and interaction with biological targets.
  • Hydroxymethyl Group: The hydroxymethyl (-CH2OH) group is not merely a functional group but is known to play a key role in enhancing solubility and improving metabolic stability in drug-like molecules.
  • Synthetic Interest: This compound can serve as a useful intermediate in organic synthesis, allowing chemists to build more complex molecules by utilizing the reactive sites present in the structure.

As chemists delve into the study of such compounds, they are often reminded of the profound complexity that underlies the simplest of structures. As one researcher stated, "The beauty of chemistry lies in understanding how the arrangement of atoms can govern such a wide array of properties and functionalities." The exploration of 6-chloro-3-(hydroxymethyl)-1,3-benzoxazol-2-one continues to inspire further research and innovation in chemical sciences, revealing new pathways in both fundamental and applied chemistry.

Synonyms
6-Chloro-3-(hydroxymethyl)benzoxazol-2(3H)-one
2275-07-2
6-chloro-3-(hydroxymethyl)-1,3-benzoxazol-2-one
6-Chloro-3-(hydroxymethyl)-2-benzoxazolinone
6-chloro-3-(hydroxymethyl)benzoxazolin-2-one
6-chloro-3-(hydroxymethyl)-1,3-benzoxazol-2(3H)-one
2(3H)-BENZOXAZOLONE, 6-CHLORO-3-(HYDROXYMETHYL)-
BRN 1111149
Hydroxymethyl-6-chlorobenzoxazolone
EINECS 218-891-1
2-Benzoxazolinone, 6-chloro-3-(hydroxymethyl)-
SCHEMBL10987080
CHEBI:38811
DTXSID20177288
PYDBIEBVVJRJRV-UHFFFAOYSA-N
STK526863
AKOS005460408
NS00049136
Q27117983