Coumarin - d6

• CAT Number: R071493
• CAS Number: 116295-83-1
• Molecular Formula: C9D6O2
• Molecular Weight: 152.18
• Purity: ≥95%
• Synonyms: Coumarin – d6
• Solubility: Pure substance
• Related CAS: 91-64-5
• IUPAC Name: 3,4,5,6,7,8-hexadeuteriochromen-2-one
• InChI: InChI=1S/C9H6O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-6H/i1D,2D,3D,4D,5D,6D
• InChIKey: ZYGHJZDHTFUPRJ-MZWXYZOWSA-N
• SMILES: [2H]C1=C(C(=C2C(=C1[2H])C(=C(C(=O)O2)[2H])[2H])[2H])[2H]

Coumarin-d6 is a deuterated form of coumarin, featuring six deuterium atoms incorporated into its molecular structure. This high-purity isotopically labeled compound is essential for research in organic chemistry, biochemistry, and analytical chemistry. Coumarin-d6 is particularly valuable for studying the metabolic pathways, reaction mechanisms, and photophysical properties of coumarin, a compound widely used in perfumes, pharmaceuticals, and as a fluorescent probe in various chemical analyses. The deuterium labeling allows for precise tracking and quantification in NMR spectroscopy, mass spectrometry, and other analytical techniques, providing enhanced accuracy in tracing molecular transformations and interactions involving coumarin. This compound is a crucial tool for researchers focusing on the synthesis of labeled compounds, the study of natural product biosynthesis, and the exploration of coumarin’s chemical and biological properties, offering consistent and reliable results in diverse experimental applications.