Description

4-Allyl-5-(Thien-2-Ylmethyl)-4H-1,2,4-Triazole-3-Thiol is a specialized heterocyclic organic compound belonging to the 1,2,4-triazole class, known for its unique sulfur and nitrogen-containing structure. This compound matters as a versatile and high-value chemical intermediate, offering a reactive thiol group and an allyl moiety for further functionalization in complex synthesis. It is primarily needed by research and development chemists in the pharmaceutical and agrochemical industries for creating novel active ingredients, as well as by manufacturers of advanced materials and fine chemicals.

Application

This compound serves as a critical building block in several advanced chemical synthesis pathways. Its primary applications include:

• Pharmaceutical Intermediate: Used in the research and synthesis of novel drug candidates, particularly those targeting neurological disorders, infectious diseases, and cancer, where the triazole-thiol scaffold is pharmacologically relevant.
• Agrochemical Synthesis: Acts as a key precursor in developing new generations of fungicides, herbicides, and insecticides, leveraging its heterocyclic structure for bioactivity.
• Ligand in Catalysis: Employed in the preparation of specialized ligands for transition metal catalysts used in cross-coupling and other organic transformations.
• Material Science Research: Investigated for incorporation into polymers or coordination complexes to impart specific electronic or binding properties.
• Chemical Biology Probes: Utilized in the design of molecular probes and inhibitors for studying enzyme function and biological pathways.

Basic Information

Product Name	4-Allyl-5-(Thien-2-Ylmethyl)-4H-1,2,4-Triazole-3-Thiol
CAS No.	667435-98-5
Molecular Formula	C10H11N3S2
Molecular Weight	237.34 g/mol
Synonyms	4-Allyl-5-(2-thienylmethyl)-4H-1,2,4-triazole-3-thiol; 4-Allyl-5-(thiophen-2-ylmethyl)-1,2,4-triazole-3-thiol; 5-[(Thiophen-2-yl)methyl]-4-(prop-2-en-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione; 4-Allyl-5-(2-thienylmethyl)-1,2,4-triazole-3-thiol; 667435-98-5; 4H-1,2,4-Triazole-3-thiol, 4-allyl-5-(2-thienylmethyl)-
EINECS	Contact for details

Quality Control

Our 4-Allyl-5-(Thien-2-Ylmethyl)-4H-1,2,4-Triazole-3-Thiol is produced under strict quality management protocols. Each batch undergoes rigorous analytical testing to ensure identity, purity, and consistency. We provide comprehensive Certificates of Analysis (COA) with each shipment, detailing key parameters such as assay (HPLC), related substances, and residual solvents. Our quality commitment aligns with cGMP principles for advanced intermediates, ensuring reliability for your critical R&D and scale-up processes.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated place at a controlled room temperature (15-25°C). This compound is easily oxidized (store under inert atmosphere) and is light-sensitive. Keep away from heat, sparks, and open flame. For long-term storage, consider packaging under an inert gas such as nitrogen or argon.

Specification

Item	Specification
Appearance	White to off-white crystalline powder
Identification (IR)	Conforms to structure
Assay (HPLC)	≥ 98.0%
Related Substances (HPLC)	Total impurities ≤ 2.0%
Loss on Drying	≤ 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.