Description

Benzoic Acid, 4-(4-((((Dimethylamino)Carbonyl)Methylamino)Carbonyl)-1- Piperazinyl)-, Hydrate (4:1) is a specialized benzoic acid derivative with a complex piperazine-based side chain, offering unique chemical functionality. This compound is valued for its role as a sophisticated intermediate in advanced organic synthesis, enabling the construction of complex molecular architectures. It is primarily required by research and development laboratories in the pharmaceutical and agrochemical sectors for the development of novel active ingredients.

Application

• Pharmaceutical Intermediate: A key building block in the research and synthesis of new drug candidates, particularly those targeting neurological or metabolic pathways.
• Agrochemical Research: Used in the development of novel herbicides, fungicides, or plant growth regulators that require specific piperazine and amide functionalities.
• Chemical Synthesis Reagent: Serves as a versatile precursor for introducing the 4-(substituted piperazinyl)benzoic acid moiety into more complex molecules.
• Bioconjugation & Linker Chemistry: Potential use in creating specialized linkers for antibody-drug conjugates (ADCs) or other bioconjugation applications due to its reactive carbonyl groups.
• Material Science Research: Can be investigated as a monomer or functional additive for creating polymers with specific thermal or solubility properties.

Basic Information

Product Name	Benzoic Acid, 4-(4-((((Dimethylamino)Carbonyl)Methylamino)Carbonyl)-1- Piperazinyl)-, Hydrate (4:1)
CAS No.	80712-35-2
Molecular Formula	C16H22N4O4 • 1/4 H2O
Molecular Weight	334.81 g/mol (Anhydrous basis)
Synonyms	4-[4-[[(Dimethylamino)carbonyl](methyl)carbamoyl]piperazin-1-yl]benzoic acid hydrate (4:1); 4-(4-((((Dimethylamino)carbonyl)(methyl)amino)carbonyl)piperazin-1-yl)benzoic acid hydrate; N,N-Dimethyl-N'-methyl-N'-[4-(4-carboxyphenyl)piperazine-1-carbonyl]urea hydrate; Benzoic acid, 4-[4-[[[(dimethylamino)carbonyl]methylamino]carbonyl]-1-piperazinyl]-, hydrate (1:0.25)
EINECS	Contact for details

Quality Control

Our Benzoic Acid, 4-(4-((((Dimethylamino)Carbonyl)Methylamino)Carbonyl)-1- Piperazinyl)-, Hydrate (4:1) is produced under strict quality management systems. Each batch undergoes rigorous analytical testing to ensure identity, purity, and consistency. Certificates of Analysis (COA) detailing specifications such as assay, impurity profile, and water content are provided and available upon request to support your quality and regulatory documentation.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated area at a controlled room temperature (typically 15-25°C). Due to its hygroscopic (moisture-sensitive) nature, the container must be kept tightly sealed after opening to prevent absorption of atmospheric moisture, which may affect stability and handling properties.

Specification

Item	Specification
Appearance	White to off-white powder
Identification (IR)	Conforms to structure
Assay (HPLC)	≥ 97.0% (on anhydrous basis)
Water Content (KF)	3.0% - 6.0% (Theoretical for 4:1 hydrate: ~1.3%)
Related Substances (HPLC)	Total impurities ≤ 3.0% Any single impurity ≤ 1.0%

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