Description

4-[[[[3-(4-Chloro-3-Nitrophenyl)-1-Oxo-2-Propenyl]Amino]Thioxomethyl]Amino]-Benzoic Acid is a specialized organic intermediate featuring a complex molecular architecture that combines a benzoic acid core with chloronitrophenyl and thioxomethylamino functionalities. This compound matters for its role as a key building block in the synthesis of advanced molecules, particularly in pharmaceutical research and the development of high-performance materials. It is primarily needed by R&D chemists and process development scientists in the pharmaceutical, agrochemical, and specialty chemical industries for constructing novel active ingredients and functional compounds.

Application

• Pharmaceutical Intermediate: Serves as a critical precursor in the synthesis of novel drug candidates, particularly those targeting specific enzyme pathways.
• Agrochemical Research: Used in the development of new herbicides, fungicides, or insecticides, leveraging its unique chloronitrophenyl moiety.
• Dye and Pigment Synthesis: Acts as a key component for creating advanced colorants and functional dyes due to its conjugated system and nitro group.
• Material Science: Employed in the research of organic semiconductors, liquid crystals, or polymers requiring specific electronic or structural properties.
• Chemical Biology Probes: Utilized in the design of molecular probes and tags for studying biological processes and protein interactions.
• Custom Synthesis & Contract Manufacturing: A valuable starting material for custom chemical synthesis services catering to diverse industrial R&D needs.

Basic Information

Product Name	4-[[[[3-(4-Chloro-3-Nitrophenyl)-1-Oxo-2-Propenyl]Amino]Thioxomethyl]Amino]-Benzoic Acid
CAS No.	530152-72-8
Molecular Formula	C17H12ClN3O5S
Molecular Weight	405.81 g/mol
Synonyms	4-({[(3E)-3-(4-Chloro-3-nitrophenyl)prop-2-enoyl]carbamothioyl}amino)benzoic acid; Benzoic acid, 4-[[[[3-(4-chloro-3-nitrophenyl)-1-oxo-2-propenyl]amino]thioxomethyl]amino]-; 4-[(3-(4-Chloro-3-nitrophenyl)acryloyl)thioureido]benzoic acid; (E)-4-((3-(4-Chloro-3-nitrophenyl)acryloyl)thioureido)benzoic acid; 530152-72-8; 4-[[[[3-(4-Chloro-3-Nitrophenyl)-1-Oxo-2-Propenyl]Amino]Thioxomethyl]Amino]Benzoic Acid
EINECS	Contact for details

Quality Control

Our 4-[[[[3-(4-Chloro-3-Nitrophenyl)-1-Oxo-2-Propenyl]Amino]Thioxomethyl]Amino]-Benzoic Acid is manufactured under strict quality management systems. Every batch undergoes rigorous analytical testing to ensure identity, purity, and consistency. We provide comprehensive Certificates of Analysis (COA) that detail specifications and results for key parameters such as assay, related substances, and residual solvents, supporting compliance with research and development standards.

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 away from heat, sparks, and open flame. Due to its light-sensitive nature, handling and storage should minimize exposure to direct light.

Specification

Item	Specification
Appearance	Yellow to orange crystalline powder
Identification (IR)	Conforms to structure
Assay (HPLC)	≥ 97.0%
Related Substances (HPLC)	Total impurities ≤ 3.0%
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.