Description

6-Chloro-2-(1,1-Dimethylethyl)-7-Benzoxazolethiol is a specialized organic sulfur compound featuring a benzoxazole core structure substituted with a chloro group and a tert-butylthiol moiety. This molecular architecture makes it a valuable key intermediate and building block in advanced organic synthesis, particularly for the development of novel heterocyclic compounds. It is primarily sought by pharmaceutical R&D and agrochemical sectors for creating active ingredients and functional materials.

Application

• Pharmaceutical Intermediate: Serves as a critical precursor in the synthesis of novel drug candidates, particularly those targeting neurological or anti-inflammatory pathways.
• Agrochemical Synthesis: Used as a key building block for developing new herbicides, fungicides, and plant growth regulators.
• Material Science Research: Employed in the creation of advanced organic electronic materials, ligands for catalysis, and specialty polymers.
• Chemical Biology Probes: Acts as a scaffold for developing molecular probes and inhibitors for enzyme and receptor studies.
• Custom Synthesis & Contract Manufacturing: Supplied to CDMOs and research institutions for bespoke chemical synthesis projects.

Basic Information

Product Name	6-Chloro-2-(1,1-Dimethylethyl)-7-Benzoxazolethiol
CAS No.	954127-39-0
Molecular Formula	C11H12ClNOS
Molecular Weight	241.73 g/mol
Synonyms	6-Chloro-2-tert-butyl-7-benzoxazolethiol; 2-(tert-Butylthio)-6-chlorobenzoxazole; 7-Benzoxazolethiol, 6-chloro-2-(1,1-dimethylethyl)-; 6-Chloro-2-(tert-butyl)-1,3-benzoxazole-7-thiol; 6-Chloro-2-tert-butyl-1,3-benzoxazole-7-thiol; 2-tert-Butylsulfanyl-6-chloro-1,3-benzoxazole; 6-Chloro-2-(tert-butylsulfanyl)benzoxazole
EINECS	Contact for details

Quality Control

Our production of 6-Chloro-2-(1,1-Dimethylethyl)-7-Benzoxazolethiol adheres to stringent quality management systems. Every batch undergoes comprehensive analytical testing, including HPLC, GC, NMR, and mass spectrometry, to ensure identity, purity, and consistency. Certificates of Analysis (COA) detailing all specifications are provided with each shipment. We support compliance with REACH and other global regulatory frameworks.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated place at room temperature (15-25°C). Keep away from strong oxidizing agents and bases. For long-term storage, consider an inert atmosphere to preserve stability.

Specification

Item	Specification
Appearance	White to off-white crystalline powder
Identification (IR)	Conforms to structure
Identification (HPLC)	Conforms to reference standard
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.