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Methyl 1-({[4-Amino-5-(Difluoromethyl)-4H-1,2,4-Triazol-3-Yl]Thio}Methyl)-1H-Pyrazole-3-Carboxylate CAS NO 956440-79-2


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CAS No.:956440-79-2

Grade:Pharmacy Grade

Content:99.9%

Brand:Customizable

Packaging:Customizable

Description

Methyl 1-({[4-Amino-5-(Difluoromethyl)-4H-1,2,4-Triazol-3-Yl]Thio}Methyl)-1H-Pyrazole-3-Carboxylate is a high-purity, advanced heterocyclic compound designed for sophisticated chemical synthesis. This molecule is valued for its unique structural features, including a difluoromethyl-substituted triazole core linked to a pyrazole ester, which are critical for imparting specific bioactivity and physicochemical properties. It serves as a key pharmaceutical intermediate and agrochemical building block for research and development in life sciences.

Application

This specialized chemical intermediate enables innovation across several high-value industrial sectors. Its primary and potential applications include:

  • Pharmaceutical Intermediate: A crucial building block for the synthesis of novel active pharmaceutical ingredients (APIs), particularly in antiviral, antifungal, and anticancer research.
  • Agrochemical Synthesis: Used in the development of next-generation pesticides, herbicides, and fungicides, leveraging the bioactive triazole and pyrazole motifs.
  • Chemical Research & Development: Serves as a versatile scaffold in medicinal chemistry for structure-activity relationship (SAR) studies and lead optimization.
  • Material Science Precursor: Potential use in creating specialty polymers or ligands with specific electronic or binding properties.

Basic Information

Product Name Methyl 1-({[4-Amino-5-(Difluoromethyl)-4H-1,2,4-Triazol-3-Yl]Thio}Methyl)-1H-Pyrazole-3-Carboxylate
CAS No. 956440-79-2
Molecular Formula C9H10F2N6O2S
Molecular Weight 304.28 g/mol
Synonyms Methyl 1-[[[4-Amino-5-(difluoromethyl)-4H-1,2,4-triazol-3-yl]thio]methyl]-1H-pyrazole-3-carboxylate; 1H-Pyrazole-3-carboxylic acid, 1-[[[4-amino-5-(difluoromethyl)-4H-1,2,4-triazol-3-yl]thio]methyl]-, methyl ester; CAS 956440-79-2; 4-Amino-5-(difluoromethyl)-4H-1,2,4-triazole-3-thiol derivative; Difluoromethyl-triazole-pyrazole ester.
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Quality Control

We maintain stringent quality control protocols for this advanced intermediate. Our products undergo rigorous analytical testing, including HPLC, NMR, and MS, to ensure high purity and batch-to-batch consistency essential for research and scale-up. A comprehensive Certificate of Analysis (COA) detailing identity, purity, and impurity profiles is provided with every shipment to support your quality and regulatory requirements.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated area at controlled room temperature (15-25°C). Keep the container sealed to protect this light-sensitive material from moisture and atmospheric contaminants.

Specification

Item Specification
Appearance White to off-white crystalline powder
Identification (HPLC/MS) Conforms
Purity (HPLC) ≥ 97.0%
Related Substances (HPLC) Total impurities ≤ 3.0%
Water Content (KF) ≤ 0.5%
Residue on Ignition ≤ 0.1%

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

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