Description

2,4,6-Triethylbenzenethiocarboxylic Acid S-(2-Hydroxy-2-Phenylbutyl) Ester is a specialized organosulfur compound with a complex ester structure, serving as a high-value intermediate in advanced chemical synthesis. Its molecular architecture makes it a critical precursor for constructing complex molecules, particularly in the development of pharmaceuticals and performance materials. This compound is essential for R&D chemists and process engineers in the pharmaceutical, agrochemical, and specialty chemical industries seeking to introduce specific thiocarboxylate functionalities.

Application

• Pharmaceutical Intermediate: A key building block in the synthesis of novel active pharmaceutical ingredients (APIs), especially those targeting neurological or metabolic pathways.
• Agrochemical Synthesis: Used in the research and development of next-generation herbicides, fungicides, and plant growth regulators.
• Ligand and Catalyst Precursor: Serves as a starting material for creating specialized ligands in transition metal catalysis and organocatalysis.
• Material Science Research: Employed in the development of advanced polymers and functional materials with specific optical or electronic properties.
• Chemical Biology Probes: Utilized in the design of molecular probes and inhibitors for studying enzyme mechanisms and biological pathways.
• Custom Synthesis and Contract Manufacturing: A vital reagent for fine chemical and CDMO (Contract Development and Manufacturing Organization) facilities producing bespoke molecules for clients.

Basic Information

Product Name	2,4,6-Triethylbenzenethiocarboxylic Acid S-(2-Hydroxy-2-Phenylbutyl) Ester
CAS No.	67902-79-8
Molecular Formula	C23H30O2S
Molecular Weight	370.55 g/mol
Synonyms	S-(2-Hydroxy-2-phenylbutyl) 2,4,6-triethylbenzenecarbothioate; 2,4,6-Triethylbenzenecarbothioic Acid S-(2-Hydroxy-2-phenylbutyl) Ester; (2-Hydroxy-2-phenylbutyl) 2,4,6-triethylbenzothioate; CAS 67902-79-8; Thiobenzoic Acid S-(2-Hydroxy-2-Phenylbutyl) Ester, 2,4,6-Triethyl Derivative
EINECS	Contact for details

Quality Control

Every batch of 2,4,6-Triethylbenzenethiocarboxylic Acid S-(2-Hydroxy-2-Phenylbutyl) Ester is manufactured under strict quality management systems. Our products undergo rigorous analytical testing, including HPLC, GC, NMR, and mass spectrometry, to ensure identity, purity, and consistency. A comprehensive Certificate of Analysis (COA) detailing all specifications is provided with each shipment to support your quality assurance and regulatory compliance needs.

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). Due to its sensitivity to oxidation, it is recommended to store under an inert atmosphere (e.g., nitrogen or argon) for long-term preservation. Keep away from heat, sparks, and open flames.

Specification

Item	Specification
Appearance	White to off-white crystalline powder or solid
Identification (IR)	Conforms to structure
Identification (NMR)	Conforms to structure
Purity (HPLC)	≥ 97.0%
Melting Point	Contact for details
Loss on Drying	≤ 0.5%
Residue on Ignition	≤ 0.1%
Heavy Metals	≤ 20 ppm

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