Description

2-Phenyl-1,3-Propanediol-D4 is a deuterium-labeled analog of 2-Phenyl-1,3-propanediol, a valuable building block in organic synthesis and analytical chemistry. This stable isotope-labeled compound is essential for use as an internal standard in quantitative mass spectrometry, ensuring high accuracy and reliability in analytical measurements. It is primarily utilized by research institutions, pharmaceutical companies, and contract research organizations (CROs) engaged in drug metabolism and pharmacokinetics (DMPK) studies, bioanalytical method development, and forensic analysis.

Application

• Internal Standard for Mass Spectrometry: Serves as a critical reference compound in LC-MS/MS and GC-MS analyses for the quantification of unlabeled 2-Phenyl-1,3-propanediol or related metabolites.
• Pharmaceutical Research: Used in drug discovery and development for tracing metabolic pathways, conducting absorption, distribution, metabolism, and excretion (ADME) studies, and validating bioanalytical assays.
• Metabolomics and Biomarker Discovery: Enables precise quantification in complex biological samples for profiling endogenous metabolites and identifying disease biomarkers.
• Chemical Synthesis: Acts as a deuterated synthon for the preparation of more complex labeled molecules for mechanistic studies or as tracers.
• Forensic and Doping Control Analysis: Provides a reliable standard for the accurate detection and quantification of substances in forensic toxicology and anti-doping programs.
• Quality Control in Manufacturing: Employed in the quality assurance of pharmaceutical products where the unlabeled compound is an intermediate or an impurity.

Basic Information

Item	Detail
Product Name	2-Phenyl-1,3-Propanediol-D4
CAS No.	98704-00-8
Molecular Formula	C9H6D4O2
Molecular Weight	~154.20 g/mol
Synonyms	2-Phenyl-1,3-propanediol-d4; 2-Phenyltrimethylene-d4 glycol; 1,3-Dihydroxy-2-phenylpropane-d4; (2-Phenyl-1,3-propanediyl-1,1,3,3-d4)diol; Phenylmalondiol-d4; α-Phenyl-β,β'-dihydroxypropane-d4; Deuterated 2-Phenyl-1,3-propanediol; [1,1,3,3-2H4]-2-Phenyl-1,3-propanediol
EINECS	Contact for details

Quality Control

Our 2-Phenyl-1,3-Propanediol-D4 is manufactured under strict quality systems to ensure high isotopic purity and chemical integrity. Each batch is characterized by advanced analytical techniques including NMR, HPLC, and mass spectrometry. A comprehensive Certificate of Analysis (COA) detailing isotopic enrichment (D-atom %), chemical purity, and specific tests is provided with every shipment to support your regulatory and research requirements.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry place at a controlled room temperature (15-25°C). Keep the container sealed to prevent moisture absorption and potential contamination.

Specification

Item	Specification
Appearance	White to off-white crystalline powder
Identification (IR)	Conforms to structure
Purity (HPLC)	≥ 98.0%
Isotopic Purity (D-atom %)	≥ 98.0%
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.