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3-{[3,5-Bis(Difluoromethyl)-1H-Pyrazol-1-Yl]Methyl}Benzoic Acid CAS NO 1001518-90-6


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CAS No.:1001518-90-6

Grade:Pharmacy Grade

Content:99.9%

Brand:Customizable

Packaging:Customizable

Description

3-{[3,5-Bis(Difluoromethyl)-1H-Pyrazol-1-Yl]Methyl}Benzoic Acid is a high-value, multi-functional organic intermediate characterized by its unique pyrazole and benzoic acid structure. This compound is critical for the synthesis of advanced molecules, offering a versatile chemical handle for further functionalization in complex organic reactions. It is primarily sought after by research and development teams in the pharmaceutical and agrochemical industries for the creation of novel active ingredients.

Application

  • Pharmaceutical Intermediate: A key building block in the synthesis of novel drug candidates, particularly for developing small molecule therapeutics with specific biological targets.
  • Agrochemical Synthesis: Used in the research and production of advanced crop protection agents, such as herbicides and fungicides, leveraging its difluoromethylpyrazole moiety.
  • Material Science Research: Serves as a precursor for specialty polymers or functional materials where the introduction of fluorine atoms can modify physical properties.
  • Chemical Research & Development: Employed as a versatile scaffold in medicinal chemistry and process chemistry for structure-activity relationship (SAR) studies and route optimization.
  • Ligand and Catalyst Development: Potential use in creating novel ligands for metal catalysis or as a component in organocatalysts due to its functional group diversity.

Basic Information

Product Name 3-{[3,5-Bis(Difluoromethyl)-1H-Pyrazol-1-Yl]Methyl}Benzoic Acid
CAS No. 1001518-90-6
Molecular Formula C13H10F4N2O2
Molecular Weight 302.23 g/mol
Synonyms 3-((3,5-Bis(difluoromethyl)-1H-pyrazol-1-yl)methyl)benzoic acid; 3-[[3,5-Bis(difluoromethyl)pyrazol-1-yl]methyl]benzoic Acid; Benzoic acid, 3-[[3,5-bis(difluoromethyl)-1H-pyrazol-1-yl]methyl]-; 1H-Pyrazole-1-acetic acid, 3,5-bis(difluoromethyl)-, 3-carboxyphenyl ester (alternative representation); [3,5-Bis(difluoromethyl)pyrazol-1-yl]methyl-benzoic acid
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Quality Control

Our production of 3-{[3,5-Bis(Difluoromethyl)-1H-Pyrazol-1-Yl]Methyl}Benzoic Acid adheres to stringent quality management protocols. Each batch undergoes comprehensive analytical testing, including HPLC for purity, NMR and IR for structural confirmation, and residual solvent analysis. Certificates of Analysis (COA) detailing all specifications are provided to ensure traceability and compliance with your research or production standards.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated area at a controlled room temperature (15-25°C). Keep away from incompatible materials such as strong oxidizing agents, strong bases, and strong acids.

Specification

Item Specification
Appearance White to off-white crystalline powder
Identification (IR) Conforms to structure
Identification (HPLC) Retention time matches reference standard
Purity (HPLC) ≥ 97.0%
Water Content (KF) ≤ 0.5%
Residual Solvents (GC) Complies with ICH Q3C guidelines

Note: Specifications can be tailored. Please contact us for the detailed technical data sheet of a specific grade.

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