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4-Bromoaniline-d4丨CAS 61357-76-4

4-Bromoaniline-d4丨CAS 61357-76-4
Product Introduction:
CAS No.: 61357-76-4
Product Name: 4-Bromoaniline-d4
Molecular Formula: C6H6BrN
Molecular Weight: 176.05
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Technical Parameters
Description

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4-Bromoaniline-d4 is a deuterium-labeled aromatic amine derived from 4-bromoaniline, with four hydrogen atoms replaced by deuterium. Featuring both a bromine substituent and an amino group, this compound is a useful building block for organic synthesis, isotope-labeling research, and the preparation of specialized aromatic derivatives. Its defined isotopic composition makes it suitable for research applications requiring deuterium-labeled chemical structures.

 

Chemical Identifiers

 

InChI InChI=1S/C6H6BrN/c7-5-1-3-6(8)4-2-5/h1-4H,8H2/i1D,2D,3D,4D
InChI Key WDFQBORIUYODSI-RHQRLBAQSA-N
Smiles [2H]C1=C(C(=C(C(=C1N)[2H])[2H])Br)[2H]
EC No.  
MDL No.  
PubChem CID 24213179

 

 

 

Applications

 

Analytical Chemistry and Mass Spectrometry

Deuterated aromatic compounds can support analytical method development and isotope-labeling studies. 4-Bromoaniline-d4 may serve as a building block for preparing labeled reference compounds or research materials used in suitable analytical workflows, including mass spectrometry.

Pharmaceutical Research and Drug Discovery

4-Bromoaniline-d4 can be used as an intermediate in the synthesis of deuterium-labeled aromatic compounds for pharmaceutical research. Isotopic labeling can help researchers investigate metabolic pathways, molecular transformations, and reaction mechanisms during drug discovery and development.

Organic Synthesis and Chemical Research

The bromine and amino functionalities provide opportunities for further chemical modification. The bromine substituent can participate in suitable cross-coupling reactions, while the amino group supports additional derivatization, making this compound useful for preparing diverse deuterated aromatic intermediates.

Materials Science and Advanced Materials

Brominated aromatic amines can be used as intermediates in the preparation of functional organic molecules. 4-Bromoaniline-d4 may support the development of specialized deuterated compounds investigated in materials science and molecular design, where isotopic labeling is relevant to the research objective.

 

 

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