Description

Dimethyl 2-Allyl-2-[2-Nitro-4-(Trifluoromethyl)Phenyl]Malonate is a specialized, high-value intermediate featuring a unique trifluoromethylphenyl and nitro-substituted malonate structure. This compound is critical for synthesizing complex molecules where the introduction of fluorine and nitro functional groups is required to modulate biological activity and physicochemical properties. It is primarily sought by research and development chemists in the pharmaceutical and agrochemical industries for the creation of novel active ingredients.

Application

• Pharmaceutical Intermediate: A key building block in the synthesis of potential drug candidates, particularly for introducing fluorinated aromatic systems and nitro groups which can influence bioavailability and metabolic stability.
• Agrochemical Synthesis: Used in the research and development of advanced herbicides, fungicides, and insecticides, where the trifluoromethyl group is a common motif for enhancing efficacy and environmental profile.
• Material Science Research: Serves as a precursor for developing specialty polymers or organic electronic materials that benefit from its specific electronic properties.
• Chemical Biology Probes: Utilized in the design and synthesis of molecular probes for studying enzyme mechanisms or biological pathways, leveraging its reactive allyl and ester functionalities.
• Custom Synthesis & Contract Manufacturing: A vital starting material for custom synthesis houses and CDMOs (Contract Development and Manufacturing Organizations) serving the life sciences sector.

Basic Information

Product Name	Dimethyl 2-Allyl-2-[2-Nitro-4-(Trifluoromethyl)Phenyl]Malonate
CAS No.	860788-97-2
Molecular Formula	C₁₅H₁₄F₃NO₆
Molecular Weight	361.27 g/mol
Synonyms	Dimethyl 2-allyl-2-(2-nitro-4-(trifluoromethyl)phenyl)malonate; 2-Allyl-2-(2-nitro-4-(trifluoromethyl)phenyl)malonic acid dimethyl ester; Propanedioic acid, 2-allyl-2-[2-nitro-4-(trifluoromethyl)phenyl]-, 1,3-dimethyl ester; Allyl Nitro Trifluoromethyl Phenyl Malonate Dimethyl Ester; DNTPM; Contact for additional synonyms.
EINECS	Contact for details

Quality Control

Our production of Dimethyl 2-Allyl-2-[2-Nitro-4-(Trifluoromethyl)Phenyl]Malonate adheres to stringent quality management protocols to ensure batch-to-batch consistency and high purity. Each lot is characterized using advanced analytical techniques including HPLC, GC, NMR, and mass spectrometry. A comprehensive Certificate of Analysis (COA) detailing identity, purity, and impurity profiles is provided with every shipment, supporting your R&D and scale-up activities.

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). This compound is easily oxidized and should be handled and stored under an inert atmosphere (e.g., nitrogen or argon) for long-term stability. Keep away from heat, sparks, and open flame.

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% (Area %)
Water Content (KF)	≤ 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.