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Naphthalene-1-[d]

General Information
Catalog: BLP-011986
CAS: 875-62-7
Molecular Formula: C10H7D
Molecular Weight: 129.18
Chemical Structure
Naphthalene-1-[d]
Synonyms Naphthalene-1-D1
IUPAC Name 1-deuterionaphthalene
Related CAS 91-20-3 (unlabelled)
Isomeric SMILES [2H]C1=C2C=CC=CC2=CC=C1
Canonical SMILES C1=CC=C2C=CC=CC2=C1
InChI InChI=1S/C10H8/c1-2-6-10-8-4-3-7-9(10)5-1/h1-8H/i5D
InChI Key UFWIBTONFRDIAS-UICOGKGYSA-N
Boiling Point 221.5°C at 760 mmHg
Purity 95% atom D
Density 1.045 g/cm3
Storage Store at -20°C

Naphthalene-1-[d] is a labeled isotopic form of naphthalene, used extensively in scientific research due to its unique properties. Here are some key applications of Naphthalene-1-[d]:

Environmental Studies: Naphthalene-1-[d] can be used as a tracer to study the fate and transport of polycyclic aromatic hydrocarbons (PAHs) in the environment. Researchers employ it to track and model the distribution and degradation of PAHs in soil and water systems. This helps in assessing environmental contamination and understanding the impact of these compounds on ecosystems.

Chemical Research: In chemical research, Naphthalene-1-[d] serves as a stable isotope-labeled compound for detailed mechanistic studies. By using this labeled version, chemists can perform NMR spectroscopy to investigate reaction pathways and the fate of naphthalene derivatives. It provides insights into the fundamental processes of aromatic compound transformations.

Pharmaceutical Development: Naphthalene-1-[d] is utilized in pharmaceutical research to study the metabolism and pharmacokinetics of naphthalene-based drugs. By incorporating the labeled compound into drug formulations, scientists can track the distribution, absorption, and elimination patterns in biological systems. This information is crucial for optimizing drug design and safety profiles.

Synthetic Chemistry: In the field of synthetic chemistry, Naphthalene-1-[d] is used to elucidate reaction mechanisms and optimize synthetic routes. The deuterated label allows researchers to distinguish between different chemical pathways and identify intermediates in complex synthesis processes. It plays a vital role in advancing the development of efficient and sustainable synthetic methodologies.

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