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Ethyl 2-[(Anilinocarbothioyl)Amino]-4,5,6,7-Tetrahydro-1-Benzothiophene-3-Carboxylate CAS NO 42076-12-0


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CAS No.:42076-12-0

Grade:Pharmacy Grade

Content:99.9%

Brand:Customizable

Packaging:Customizable

Description

Ethyl 2-[(Anilinocarbothioyl)Amino]-4,5,6,7-Tetrahydro-1-Benzothiophene-3-Carboxylate is a high-purity organic compound with the CAS number 42076-12-0, serving as a critical advanced intermediate in pharmaceutical synthesis. Its complex molecular structure, featuring fused tetrahydrobenzothiophene and thiourea moieties, makes it a valuable building block for developing novel active pharmaceutical ingredients (APIs). This product is essential for research and development chemists and manufacturers in the pharmaceutical and agrochemical industries seeking to create new therapeutic or crop protection agents.

Application

  • Pharmaceutical Intermediate: A key precursor in the synthesis of novel drug candidates, particularly those targeting central nervous system (CNS) disorders or possessing specific receptor-binding activity.
  • Agrochemical Research: Used in the development of new pesticides and herbicides, leveraging its heterocyclic structure for biological activity.
  • Chemical Synthesis Building Block: Employed in organic chemistry research for constructing complex sulfur- and nitrogen-containing heterocycles.
  • Material Science Research: Investigated as a potential monomer or additive for specialty polymers due to its unique molecular architecture.
  • Academic & Industrial R&D: Serves as a standard or starting material in laboratories focused on medicinal chemistry and process development.

Basic Information

Item Details
Product Name Ethyl 2-[(Anilinocarbothioyl)Amino]-4,5,6,7-Tetrahydro-1-Benzothiophene-3-Carboxylate
CAS No. 42076-12-0
Molecular Formula C18H22N2O2S2
Molecular Weight 362.51 g/mol
Synonyms Ethyl 2-[(phenylcarbamothioyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate; 2-[(Anilinothioxomethyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic Acid Ethyl Ester; 42076-12-0; 1-Benzothiophene-3-carboxylic acid, 2-[(aminothioxomethyl)amino]-4,5,6,7-tetrahydro-, ethyl ester; Ethyl 2-(3-phenylthioureido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate
EINECS Contact for details

Quality Control

Our Ethyl 2-[(Anilinocarbothioyl)Amino]-4,5,6,7-Tetrahydro-1-Benzothiophene-3-Carboxylate is manufactured under strict quality management systems. Each batch undergoes rigorous analytical testing, including HPLC for purity and identity confirmation via spectroscopic methods (IR, NMR), to ensure it meets exacting standards for research and production use. A comprehensive Certificate of Analysis (COA) detailing purity, assay, and impurity profiles is provided with every shipment.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, well-ventilated area at a controlled room temperature (15-25°C). This compound is light-sensitive and easily oxidized; for long-term storage, consider keeping under an inert atmosphere (e.g., nitrogen or argon) to maintain stability and purity.

Specification

Item Specification
Appearance White to off-white crystalline powder
Identification (IR) Conforms to structure
Purity (HPLC) ≥ 98.0%
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.

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