Description

2-Nitrotoluene-3,4,5,6-D4 is a deuterium-labeled isotopologue of 2-nitrotoluene, a key aromatic nitro compound. This stable isotope-labeled material is essential for applications requiring high analytical precision and minimal background interference. It is primarily utilized by researchers and analytical chemists in the pharmaceutical, agrochemical, and environmental science sectors for use as an internal standard in mass spectrometry and NMR spectroscopy.

Application

• Internal Standard for Quantitative Analysis: Used in LC-MS, GC-MS, and NMR for accurate quantification of 2-nitrotoluene and related metabolites in complex matrices.
• Pharmaceutical Research: Serves as a tracer in drug metabolism and pharmacokinetics (DMPK) studies to understand the fate of nitroaromatic compounds.
• Environmental Monitoring: Enables precise tracking and analysis of nitrotoluene pollutants and their degradation pathways in environmental samples.
• Chemical Synthesis & Mechanistic Studies: Acts as a labeled precursor or probe in synthetic organic chemistry and reaction mechanism investigations.
• Forensic & Regulatory Science: Supports method development and validation for the detection of nitroaromatic compounds in compliance and forensic laboratories.

Basic Information

Product Name	2-Nitrotoluene-3,4,5,6-D4
CAS No.	115049-76-8
Molecular Formula	C7H3D4NO2
Molecular Weight	141.17 g/mol
Synonyms	2-Nitrotoluene-d4; 2-Methylnitrobenzene-d4; o-Nitrotoluene-d4; 1-Methyl-2-nitrobenzene-d4; 2-NT-d4; Deuterated 2-Nitrotoluene; [2H4]-2-Nitrotoluene; (2H4)2-Nitrotoluene
EINECS	Contact for details

Quality Control

Every batch of 2-Nitrotoluene-3,4,5,6-D4 is produced and analyzed under strict quality protocols to ensure the highest isotopic and chemical purity for research applications. Our products undergo rigorous quality testing, including spectroscopic and chromatographic analysis, to ensure compliance with industry standards. Certificates of Analysis (COA) detailing isotopic enrichment, chemical purity, and analytical methods are available upon request.

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). Keep away from strong acids and organic solvents. For long-term stability, consider storage under an inert atmosphere.

Specification

Item	Specification
Appearance	Yellow to orange crystalline solid or liquid
Identification (IR / NMR)	Conforms to structure
Isotopic Enrichment (D)	≥ 98 atom % D
Chemical Purity (HPLC/GC)	≥ 98.0%
Water Content (KF)	≤ 0.5%

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