2-Bromonaphthalene-d7丨CAS 1359833-48-9

2-Bromonaphthalene-d7丨CAS 1359833-48-9
Product Introduction:
CAS No.: 1359833-48-9
Product Name: 2-Bromonaphthalene-d7
Molecular Formula: C10H7Br
Molecular Weight: 214.11
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Technical Parameters
Description

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2-Bromonaphthalene-d7 is a deuterium-labeled aromatic compound featuring a naphthalene ring system, a bromine substituent at the 2-position, and seven deuterium atoms. Its fused aromatic structure and reactive carbon–bromine bond make it a useful intermediate for organic synthesis, isotope-labeling research, and the preparation of advanced functional molecules. The combination of a defined isotopic structure and a versatile halogen substituent supports further molecular modification.

 

Chemical Identifiers

 

InChI InChI=1S/C10H7Br/c11-10-6-5-8-3-1-2-4-9(8)7-10/h1-7H/i1D,2D,3D,4D,5D,6D,7D
InChI Key APSMUYYLXZULMS-GSNKEKJESA-N
Smiles [2H]C1=C(C(=C2C(=C(C(=C(C2=C1[2H])[2H])[2H])Br)[2H])[2H])[2H]
EC No.  
MDL No.  
PubChem CID 89310078

 

 

 

Applications

 

Deuterium Labeling and Mechanistic Studies

The seven deuterium atoms provide an isotopic label within the naphthalene framework. Researchers can use this feature to investigate isotope effects, reaction pathways, and chemical transformations, or to prepare deuterium-labeled derivatives for specialized mechanistic studies.

Pharmaceutical Research and Drug Discovery

Naphthalene-based structures are explored in medicinal chemistry and the development of biologically active molecules. This deuterated intermediate may support the synthesis of labeled analogues and substituted aromatic compounds for drug discovery, molecular design, and structure–activity relationship studies, depending on the target structure.

Organic Synthesis and Cross-Coupling Reactions

The bromine substituent provides a reactive site for further functionalization through suitable transition-metal-catalyzed cross-coupling reactions, including Suzuki–Miyaura and related transformations. 2-Bromonaphthalene-d7 can be used to introduce a deuterated naphthalene unit into more complex aromatic structures, supporting the synthesis of labeled biaryl compounds and other functional derivatives.

Materials Science and Organic Electronics

Naphthalene derivatives are investigated in the development of conjugated molecules and functional organic materials. 2-Bromonaphthalene-d7 can serve as a synthetic building block for incorporating a deuterated aromatic unit into larger molecular architectures for research into molecular structure and material properties.

 

 

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