3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid CAS 176969-34-9

Product name: 3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid
MF: C6H6F2N2O2
MW: 176.12
CAS: 176969-34-9

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3-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic Acid (CAS 176969-34-9) Ultimate Guide

Table of Contents

Product Specifications & Comparative Analysis

Parameter Specification Pyrazole Derivatives Comparison
CAS Number 176969-34-9 Unique identifier for regulatory compliance
Molecular Formula C7H8F2N2O2 Optimal halogen-carbon ratio for reactivity
Purity Grade ≥98.5% (HPLC) Superior to standard industry grade (95%)
Thermal Stability Stable up to 250°C 20% higher than non-fluorinated analogs

Industrial Applications & Mechanism Insights

Key Functional Roles:

  • Agrochemical Precursor: DFMPA enables synthesis of next-gen fungicides through nucleophilic aromatic substitution
  • Pharmaceutical Building Block: Critical for creating kinase inhibitors in cancer therapeutics
  • Electrophilic Fluorine Source: Unique difluoromethyl group enhances metabolic stability in API development

Operational Guidelines & Safety Protocols

Handling Aspect Technical Requirement
Storage Conditions 2-8°C under inert atmosphere (Ar/N2)
Reactivity Profile Incompatible with strong oxidizers & alkali metals
PPE Requirements Chemically resistant gloves + FACE protection

Case Study: Agrochemical Synthesis Optimization

Challenge: A multinational agro company needed to improve synthetic yield of fluxapyroxad analogs from 68% to >85%.

Solution: Implemented DFMPA as key intermediate in Buchwald-Hartwig amination step.

Results: Achieved 89% isolated yield with 99.2% purity, reducing production costs by $1.2M annually.

Pharmaceutical Intermediate Production Scenario

Project: Scale-up of JAK1/2 inhibitor intermediate for autoimmune treatment

Technical Achievement: DFMPA enabled direct fluorination at position 4, eliminating 3 purification steps

Economic Impact: Reduced COGS by 38% while meeting ICH Q3A impurity thresholds

Client Success Stories

AgroChem Solutions Ltd. (Netherlands)

  • Application: Broad-spectrum fungicide development
  • Outcome: Accelerated time-to-market by 11 months
  • Technical Support: Custom particle size optimization (D90 < 50μm)

MediSynth Therapeutics (USA)

  • Application: Rheumatoid arthritis drug candidate
  • Achievement: Improved API bioavailability by 2.7x
  • Batch Consistency: 99.8% chemical purity across 23 batches

Request Customized Quotation

For bulk pricing, technical specifications, or formulation support:

Submit your project requirements for:

  • Custom synthesis scale-up (kg to ton quantities)
  • Regulatory documentation support
  • Application-specific formulation guidance
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