6608-82-8

Basic information

• Product Name: 2-[2-[[4-[3-(4-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]phenyl]sulphonyl]ethoxy]-N,N-dimethylpropylamine
• Synonyms: 2-[2-[[4-[3-(4-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]phenyl]sulphonyl]ethoxy]-N,N-dimethylpropylamine;2-[2-[4-[3-(4-Chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]phenylsulfonyl]ethoxy]-N,N-dimethyl-1-propanamine
• CAS NO: 6608-82-8
• Molecular Formula: C₂₂H₂₈ClN₃O₃S
• Molecular Weight: 449.99402
• EINECS: 229-558-5
• Mol File: 6608-82-8.mol
• Article Data: 0

Chemical Properties

• Boiling Point: 604.6°C at 760 mmHg
• Flash Point: 319.5°C
• Appearance: /
• Density: 1.24g/cm³
• Vapor Pressure: 1.43E-14mmHg at 25°C
• Refractive Index: 1.594
• CAS DataBase Reference: 2-[2-[[4-[3-(4-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]phenyl]sulphonyl]ethoxy]-N,N-dimethylpropylamine(CAS DataBase Reference)
• NIST Chemistry Reference: 2-[2-[[4-[3-(4-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]phenyl]sulphonyl]ethoxy]-N,N-dimethylpropylamine(6608-82-8)
• EPA Substance Registry System: 2-[2-[[4-[3-(4-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]phenyl]sulphonyl]ethoxy]-N,N-dimethylpropylamine(6608-82-8)

Safety Data

• Hazardous Substances Data: 6608-82-8(Hazardous Substances Data)

Usage

Functional Groups

Sulphonyl group: Indicates the presence of a sulfone functional group (SO2), enhancing chemical reactivity.
Amine group: Signifies the presence of a nitrogen atom bonded to two hydrogen atoms, contributing to basic properties and potential reactivity.
Chlorophenyl group: Indicates a benzene ring substituted with a chlorine atom, affecting the compound's chemical and physical properties.

Structural Features

Pyrazole ring: A five-membered aromatic heterocycle containing nitrogen atoms, influencing the compound's chemical behavior and potential applications.
Ethoxy group: Indicates the presence of an ethyl group bonded to an oxygen atom, possibly influencing solubility and reactivity.
N,N-dimethylpropylamine group: Suggests the presence of a tertiary amine with two methyl groups and a propyl group attached to the nitrogen atom, indicating potential uses as a solvent, reagent, or precursor in chemical synthesis.

Potential Applications

Pharmaceuticals: Due to its complex structure and varied functional groups, it may have applications in drug discovery and development.
Agrochemicals: The compound's diverse structure could make it useful in formulating pesticides, herbicides, or fungicides.
Materials Science: Its structural complexity may allow for applications in the synthesis of advanced materials or polymers.

Safety Considerations

Reactivity: The compound's complexity suggests potential reactivity, requiring careful handling to avoid unintended reactions.
Hazardous Properties: Specific hazards may arise from the presence of certain functional groups, such as the sulphonyl and chlorophenyl groups, necessitating proper safety protocols during handling and storage.

InChI:InChI=1/C22H28ClN3O3S/c1-17(16-25(2)3)29-14-15-30(27,28)21-10-8-20(9-11-21)26-13-12-22(24-26)18-4-6-19(23)7-5-18/h4-11,17H,12-16H2,1-3H3