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1-Bromonaphthalene-d7丨CAS 37621-57-1

1-Bromonaphthalene-d7丨CAS 37621-57-1
Product Introduction:
CAS No.: 37621-57-1
Product Name: 1-Bromonaphthalene-d7
Molecular Formula: C10H7Br
Molecular Weight: 214.11
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Technical Parameters
Description

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1-Bromonaphthalene-d7 is a deuterium-labeled aromatic compound consisting of a naphthalene ring system with a bromine substituent at the 1-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 specialized aromatic compounds. The deuterium labeling also supports investigations into isotopic effects and the properties of labeled molecules.

 

Chemical Identifiers

 

InChI InChI=1S/C10H7Br/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7H/i1D,2D,3D,4D,5D,6D,7D
InChI Key DLKQHBOKULLWDQ-GSNKEKJESA-N
Smiles [2H]C1=C(C(=C2C(=C1[2H])C(=C(C(=C2Br)[2H])[2H])[2H])[2H])[2H]
EC No.  
MDL No.  
PubChem CID 45038458

 

 

 

Applications

 

Deuterium Labeling and Mechanistic Studies

The seven deuterium atoms provide an isotopic label within the naphthalene framework. This feature can help researchers investigate isotope effects, reaction pathways, and chemical transformations, as well as prepare deuterium-labeled derivatives for specialized experimental studies.

Pharmaceutical Research and Drug Discovery

Naphthalene-based structures are found in a variety of compounds investigated in medicinal chemistry. This deuterated intermediate may support the synthesis of labeled analogues and structurally modified aromatic compounds for drug discovery, molecular design, and structure–activity relationship studies.

Organic Synthesis and Cross-Coupling Reactions

The bromine substituent provides a versatile reaction site for further functionalization through suitable palladium- or other transition-metal-catalyzed cross-coupling reactions. 1-Bromonaphthalene-d7 can be used to introduce a deuterated naphthalene unit into more complex molecular structures, including biaryl compounds and functional aromatic derivatives.

Materials Science and Organic Electronics

Naphthalene derivatives are investigated in the development of conjugated molecules and functional organic materials. 1-Bromonaphthalene-d7 can serve as a synthetic building block for incorporating a deuterated aromatic unit into larger molecular architectures, supporting research into molecular structure and material properties.

 

 

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