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1-Bromohexane-[2,2,3,3,4,4,5,5,6,6,6-d11]

General Information
Catalog: BLP-010253
CAS: 2159-17-3
Molecular Formula: C6H2D11Br
Molecular Weight: 176.14
Chemical Structure
1-Bromohexane-[2,2,3,3,4,4,5,5,6,6,6-d11]
Description 1-Bromohexane-[2,2,3,3,4,4,5,5,6,6,6-d11] is a labelled analogue and is intended for use as an internal standard for 1-Bromohexane. 1-Bromohexane is a very useful synthetic intermediate for pharmaceuticals and organic chemicals. It can be used to react with Mg to prepare Grignard reagents which plays an important role in formation of carbon-carbon bond.
Synonyms Hexane-1,1,1,2,2,3,3,4,4,5,5-d11, 6-bromo-
IUPAC Name 6-bromo-1,1,1,2,2,3,3,4,4,5,5-undecadeuteriohexane
Related CAS 111-25-1 (unlabelled)
Canonical SMILES CCCCCCBr
InChI InChI=1S/C6H13Br/c1-2-3-4-5-6-7/h2-6H2,1H3/i1D3,2D2,3D2,4D2,5D2
InChI Key MNDIARAMWBIKFW-GILSBCIXSA-N
Purity 98% atom D

1-Bromohexane-[2,2,3,3,4,4,5,5,6,6,6-d11] is a deuterated compound widely used in various scientific fields due to its unique properties. Here are some key applications of 1-Bromohexane-[2,2,3,3,4,4,5,5,6,6,6-d11]:

Nuclear Magnetic Resonance (NMR) Spectroscopy: This deuterated compound is often used as a solvent or internal standard in NMR spectroscopy. Its deuterium atoms minimize background signals, enhancing spectral resolution and sensitivity. Researchers use it to obtain clear and precise results, crucial for structural determination and analysis of complex molecules.

Isotope Labeling Studies: 1-Bromohexane-[2,2,3,3,4,4,5,5,6,6,6-d11] is valuable in studying reaction mechanisms and pathways through isotope labeling. By incorporating deuterium, scientists can trace the movement and transformation of molecules in chemical reactions. This insight is important for understanding dynamic processes and designing novel catalysts or drugs.

Material Science: In material science, deuterated compounds like 1-Bromohexane-[2,2,3,3,4,4,5,5,6,6,6-d11] are used to study surface interactions and molecular dynamics. These studies aid in the development of new materials with tailored properties for specific applications. Researchers leverage isotope effects to examine interactions at the molecular level, advancing innovations in polymers and nanomaterials.

Environmental Tracing: In environmental chemistry, 1-Bromohexane-[2,2,3,3,4,4,5,5,6,6,6-d11] serves as a tracer for understanding pollutant dispersal and transformation. Its isotope labeling facilitates the tracking of contaminants in ecosystems. This application enhances our ability to monitor environmental health and develop strategies for pollution mitigation.

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