1,2-Octanediol-d13

• CAT Number: R018429
• CAS Number: NA
• Molecular Formula: C₈H₅D₁₃O₂
• Molecular Weight: 159.31
• Purity: ≥95%
• Synonyms: (±)-Octane-1,2-diol-d13; 1,2-Dihydroxyoctane-d13; 1,2-Octylene Glycol-d13; 7,8-Dihydroxyoctane-d13; Caprylyl Glycol-d13; Dermosoft Octiol-d13; LexGard O-d13; NSC 71546-d13; Sodiol ON-D-d13; n-Octane-1,2-Diol-d13
• Storage: -20°C
• IUPAC Name: 3,3,4,4,5,5,6,6,7,7,8,8,8-tridecadeuteriooctane-1,2-diol
• InChI: InChI=1S/C8H18O2/c1-2-3-4-5-6-8(10)7-9/h8-10H,2-7H2,1H3/i1D3,2D2,3D2,4D2,5D2,6D2
• InChIKey: AEIJTFQOBWATKX-UTBWLCBWSA-N
• SMILES: [2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C(CO)O

1,2-Octanediol-d13 is a deuterium-labeled analogue of 1,2-octanediol, a long-chain diol used in various applications including as a solvent and in the synthesis of surfactants and polymers. The deuterium labeling allows for precise tracking and quantification in metabolic and analytical studies using mass spectrometry. This compound is valuable in research focused on understanding the metabolic pathways and environmental fate of long-chain alcohols. Its applications extend to investigating the behavior of diols in chemical processes and developing new materials with enhanced properties in industrial and pharmaceutical contexts.