Description

3-Nitrobenzyl Alcohol-Od CAS NO 117897-59-3 is a deuterated derivative of 3-nitrobenzyl alcohol, where specific hydrogen atoms are replaced with deuterium, a stable hydrogen isotope. This isotopic labeling is critical for applications requiring precise molecular tracking and analysis, such as in advanced spectroscopic studies and as an internal standard in quantitative mass spectrometry. It serves as a valuable building block and analytical tool for researchers and manufacturers in the pharmaceutical, agrochemical, and academic research sectors, particularly in drug metabolism and pharmacokinetics (DMPK) studies.

Application

• Internal Standard for Quantitative Mass Spectrometry (LC-MS/MS, GC-MS)
• Tracer Compound in Drug Metabolism and Pharmacokinetics (DMPK) Studies
• Intermediate for the Synthesis of Deuterated Pharmaceutical Compounds
• Probe Molecule in Nuclear Magnetic Resonance (NMR) Spectroscopy
• Reference Material in Analytical Method Development and Validation
• Building Block for Deuterated Liquid Crystals and Advanced Materials
• Isotopic Dilution Analysis in Environmental and Forensic Testing

Basic Information

Product Name	3-Nitrobenzyl Alcohol-Od
CAS No.	117897-59-3
Molecular Formula	C7H6DNO3
Molecular Weight	155.15 g/mol (approx.)
Synonyms	(3-Nitrophenyl)methanol-Od; 3-Nitrobenzenemethanol-Od; Deuterated 3-Nitrobenzyl Alcohol; 3-Nitrobenzyl-d Alcohol; 3-Nitrobenzyl Alcohol (Deuterated); α-Deuterio-3-nitrobenzyl Alcohol; m-Nitrobenzyl Alcohol-Od; 3-Nitrobenzyl-α-d Alcohol
EINECS	Contact for details

Quality Control

Our 3-Nitrobenzyl Alcohol-Od is produced under strict quality management protocols to ensure high isotopic purity and chemical integrity, essential for sensitive analytical applications. Each batch is characterized by advanced analytical techniques including NMR, HPLC, and Mass Spectrometry to confirm deuterium incorporation and chemical purity. A comprehensive Certificate of Analysis (COA) detailing isotopic enrichment, chemical purity, and analytical results is provided with every shipment.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry place at a controlled room temperature (typically 15-25°C). The compound is light-sensitive (store away from light). For long-term storage, consider storing under an inert atmosphere to maintain isotopic and chemical stability.

Specification

Item	Specification
Appearance	White to off-white crystalline powder
Identification (IR)	Conforms to structure
Identification (NMR)	Conforms to structure
Purity (HPLC)	≥ 98.0%
Isotopic Purity (Deuterium Content)	≥ 98 atom % D (by NMR or MS)
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.