Description

3-Aminobenzotrifluoride-D4 is a deuterated aromatic amine derivative, specifically the tetradeutero isotopologue of 3-aminobenzotrifluoride. This compound is a critical building block in the synthesis of isotopically labeled materials, offering unique value for research and development where molecular tracking and spectroscopic studies are required. It is primarily needed by pharmaceutical, agrochemical, and advanced materials research laboratories for applications in drug discovery, metabolic studies, and the development of analytical standards.

Application

• Pharmaceutical Research: As a deuterium-labeled intermediate in the synthesis of isotopically labeled Active Pharmaceutical Ingredients (APIs) for pharmacokinetic, metabolic, and mass spectrometry studies.
• Analytical Chemistry: Serving as an internal standard or reference material in quantitative NMR, LC-MS, and GC-MS analysis to ensure accuracy and precision.
• Agrochemical Development: Used in the creation of deuterated analogs of herbicides, fungicides, and pesticides for environmental fate and metabolism research.
• Material Science: As a precursor for synthesizing deuterated polymers, liquid crystals, or organic electronic materials to study structure-property relationships.
• Chemical Biology: Employed in proteomics and metabolomics for tracing biochemical pathways and mechanisms of action.
• Regulatory & Safety Testing: Facilitating studies required for regulatory submissions by providing traceable compounds for absorption, distribution, metabolism, and excretion (ADME) profiling.

Basic Information

Product Name	3-Aminobenzotrifluoride-D4
CAS No.	1219802-14-8
Molecular Formula	C7H3D4F3N
Molecular Weight	164.13 g/mol (approx.)
Synonyms	3-(Trifluoromethyl)aniline-d4; α,α,α-Trifluoro-m-toluidine-d4; 3-Amino-α,α,α-trifluorotoluene-d4; m-Aminobenzotrifluoride-D4; 3-Trifluoromethylaniline-d4; m-Trifluoromethylaniline-d4; 1-Amino-3-(trifluoromethyl)benzene-d4; Benzenamine, 3-(trifluoromethyl)-, tetradeutero-
EINECS	Contact for details

Quality Control

Our 3-Aminobenzotrifluoride-D4 is produced under strict quality management systems. Each batch undergoes rigorous analytical testing, including NMR (for deuterium incorporation), HPLC, and GC-MS, to ensure high chemical and isotopic purity. Certificates of Analysis (COA) detailing batch-specific results are available upon request. We support compliance with various research and development standards.

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). Keep away from incompatible materials such as strong alkalis and fluorides. For long-term storage under inert atmosphere, please contact our technical team for specific recommendations.

Specification

Item	Specification
Appearance	Colorless to pale yellow liquid
Identification (IR)	Conforms to structure
Purity (HPLC)	≥ 98.0%
Isotopic Purity (NMR)	≥ 98 atom % D
Water Content (KF)	≤ 0.5%

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