151971

Octan-d₁₈

98 atom % D

• Lineare Formel: CD₃(CD₂)₆CD₃
• CAS-Nummer: 17252-77-6
• Molekulargewicht: 132.34
• EG-Nummer: 241-285-3
• MDL-Nummer: MFCD00037626
• UNSPSC-Code: 12142201
• PubChem Substanz-ID: 24849186
• NACRES: NA.21

Eigenschaften

• Isotopenreinheit: 98 atom % D
• Qualitätsniveau: 200
• Assay: 99% (CP)
• Form: liquid
• Expl.-Gr.: 0.34-6.3 % (lit.)
• Methode(n): NMR: suitable
• Brechungsindex: n20/D 1.394 (lit.)
• bp: 125-127 °C
• mp (Schmelzpunkt): -57 °C (lit.)
• Dichte: 0.815 g/mL at 25 °C (lit.)
• Massenverschiebung: M+18
• SMILES String: [2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])[2H]
• InChI: 1S/C8H18/c1-3-5-7-8-6-4-2/h3-8H2,1-2H3/i1D3,2D3,3D2,4D2,5D2,6D2,7D2,8D2
• InChIKey: TVMXDCGIABBOFY-VAZJTQEUSA-N

Beschreibung

Allgemeine Beschreibung

Octane-d₁₈ is a deuterated NMR solvent. It is useful in NMR-based research and analyses. It can be prepared starting from n-octane. It undergoes H/D (Hydrogen/Deuterium) exchange reaction with mono pinacolboryl complex at 110°C.

Anwendung

Octane-d₁₈ has been used to evaluate the separation factors of the deuterated octane isomers by gas chromatography (GC).

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Sicherheitshinweise

• Piktogramme: GHS02,GHS08,GHS07,GHS09
• Signalwort: Danger
• H-Sätze: H225,H304,H315,H336,H410
• P-Sätze: P210 - P233 - P273 - P301 + P310 - P303 + P361 + P353 - P331
• Gefahreneinstufungen: Aquatic Acute 1 - Aquatic Chronic 1 - Asp. Tox. 1 - Flam. Liq. 2 - Skin Irrit. 2 - STOT SE 3
• Zielorgane: Central nervous system
• Lagerklassenschlüssel: 3 - Flammable liquids
• WGK: WGK 2
• Flammpunkt (°F): 55.4 °F - closed cup
• Flammpunkt (°C): 13 °C - closed cup