452556

Ethanol-OD

99 atom % D

• 別名: エチルアルコール-d
• 化学式: C₂H₅OD
• CAS番号: 925-93-9
• 分子量: 47.07
• Beilstein: 1731246
• EC Number: 213-128-9
• MDL番号: MFCD00044669
• UNSPSCコード: 12142201
• PubChem Substance ID: 24868710
• NACRES: NA.21
• bp: 78 °C (lit.)

特性

• 同位体純度: 99 atom % D
• 品質水準: 100
• アッセイ: 99% (CP)
• フォーム: liquid
• expl. lim.: 3.5-15 % (lit.)
• テクニック: NMR: suitable
• 不純物: ≤0.5000% water; water
• 屈折率: n20/D 1.359 (lit.)
• bp: 78 °C (lit.)
• mp: -114 °C (lit.)
• 密度: 0.806 g/mL at 25 °C
• 質量シフト: M+1
• SMILES記法: [2H]OCC
• InChI: 1S/C2H6O/c1-2-3/h3H,2H2,1H3/i3D
• InChI Key: LFQSCWFLJHTTHZ-WFVSFCRTSA-N

詳細

詳細

Ethan(ol-d) (ethanol-d, ethanol-d₁) is a deuterated NMR solvent useful in NMR-based research and analyses. It can be prepared by reacting tetraethylorthosilicate with deuterium oxide. The hydrogen bonding in ethanol-d₁ has been investigated based on Raman spectral data. The far infrared (FIR) spectrum of ethanol-d₁ has been studied using ab initio calculations.

アプリケーション

Ethan(ol-d) may be used as a source of deuterium for the deuterium exchange reaction of ethyl acetoacetate.

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安全性情報

• ピクトグラム: GHS02,GHS07
• シグナルワード: Danger
• 危険有害性情報: H225,H319
• 注意書き: P210 - P233 - P240 - P241 - P242 - P305 + P351 + P338
• 危険有害性の分類: Eye Irrit. 2 - Flam. Liq. 2
• 保管分類コード: 3 - Flammable liquids
• WGK: WGK 1
• 引火点(°F): 55.4 °F - closed cup
• 引火点(℃): 13 °C - closed cup