Description

n-Hexyl-2,2,3,3,4,4,5,5,6,6,6-D11 Alcohol is a deuterated analog of 1-hexanol, where eleven hydrogen atoms are replaced by the stable isotope deuterium. This high isotopic purity makes it an essential tool for advanced research and analytical applications, providing a non-radioactive tracer with distinct spectroscopic properties. It is primarily utilized by scientists in the pharmaceutical, agrochemical, and material science industries for mechanistic studies, metabolic pathway tracing, and as an internal standard in quantitative mass spectrometry.

Application

• Internal Standard for Mass Spectrometry (MS): Used in quantitative LC-MS and GC-MS analysis due to its nearly identical chemical behavior but distinct mass-to-charge ratio compared to its protonated counterpart.
• Metabolic Pathway Tracing: Serves as a stable isotope-labeled tracer in pharmacokinetic and drug metabolism studies to track the fate of molecules in biological systems.
• NMR Spectroscopy Solvent & Reagent: Employed in nuclear magnetic resonance (NMR) spectroscopy as a deuterated solvent or reagent to simplify spectra and study molecular structures.
• Mechanistic Reaction Studies: Acts as a probe in chemical reaction mechanisms, particularly in studies involving hydrogen/deuterium (H/D) exchange or kinetic isotope effects.
• Polymer & Material Science Research: Used in the synthesis of deuterated polymers and materials for specialized applications in optics and neutron scattering experiments.
• Agrochemical Research: Applied in environmental fate studies and metabolic profiling of pesticides and herbicides.

Basic Information

Product Name	n-Hexyl-2,2,3,3,4,4,5,5,6,6,6-D11 Alcohol
CAS No.	2159-18-4
Molecular Formula	C6D11HO
Molecular Weight	107.20 g/mol (theoretical)
Synonyms	1-Hexanol-d11; Deuterated 1-Hexanol; 1-Hexan-d11-ol; Perdeuterated Hexyl Alcohol; Hexyl Alcohol-d11; n-Hexyl-d11 Alcohol; [2,2,3,3,4,4,5,5,6,6,6-2H11]Hexan-1-ol; 1-Hydroxyhexane-d11
EINECS	Contact for details

Quality Control

Our deuterated compounds are produced under strict quality protocols to ensure high isotopic and chemical purity. Each batch is characterized by advanced analytical techniques including NMR, GC-MS, and HPLC. A comprehensive Certificate of Analysis (COA) is provided, detailing isotopic enrichment (atom % D), chemical purity, and relevant spectroscopic data to meet the exacting requirements of research and analytical laboratories.

Storage

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

Specification

Item	Specification
Appearance	Colorless to pale yellow liquid
Identification (IR)	Conforms to structure
Isotopic Purity (Atom % D)	≥ 98% (by 1H NMR or MS)
Chemical Purity (GC)	≥ 97%
Water Content (KF)	≤ 0.5%

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